From a0801e83e1aef2da09ccb599671b5ab82109a63b Mon Sep 17 00:00:00 2001 From: Santosh Shanbhogue Date: Sat, 20 Aug 2016 23:50:11 -0400 Subject: [PATCH] Add batch reactor example demonstrating NTC behavior Resolves #4 --- README.md | 3 + .../batch_reactor_ignition_delay_NTC.ipynb | 1973 +++++ reactors/data/seiser.cti | 7431 +++++++++++++++++ 3 files changed, 9407 insertions(+) create mode 100644 reactors/batch_reactor_ignition_delay_NTC.ipynb create mode 100644 reactors/data/seiser.cti diff --git a/README.md b/README.md index ece4858..5a7c907 100644 --- a/README.md +++ b/README.md @@ -27,6 +27,9 @@ there is no installation required. * [Flame speed calculator with sensitivity analysis](https://github.com/Cantera/cantera-jupyter/blob/master/flames/flame_speed_with_sensitivity_analysis.ipynb) * [Counter-flow twin premixed flame simulator](https://github.com/Cantera/cantera-jupyter/blob/master/flames/twin_premixed_flame_axisymmetric.ipynb) +* Reactor Models + * [Batch Reactor : Illustration of Ignition Delay Calculation](https://github.com/Cantera/cantera-jupyter/blob/master/reactors/batch_reactors_ignition_delay_NTC.ipynb) + ## Frequently Asked Questions **How do I use Cantera with Python?** diff --git a/reactors/batch_reactor_ignition_delay_NTC.ipynb b/reactors/batch_reactor_ignition_delay_NTC.ipynb new file mode 100644 index 0000000..6d993fa --- /dev/null +++ b/reactors/batch_reactor_ignition_delay_NTC.ipynb @@ -0,0 +1,1973 @@ +{ + "cells": [ + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "# Batch Reactor Example\n", + "## Ignition delay computation\n", + "\n", + "In this example we will illustrate how to setup and use a constant volume batch reactor. This reactor will then be used to compute the ignition delay of a gas at any temperature and pressure\n", + "\n", + "The reactor (system) is simply an insulated box." + ] + }, + { + "cell_type": "code", + "execution_count": 1, + "metadata": { + "collapsed": false + }, + "outputs": [ + { + "name": "stdout", + "output_type": "stream", + "text": [ + "Runnning Cantera version: 2.3.0a3\n" + ] + } + ], + "source": [ + "from __future__ import division\n", + "from __future__ import print_function\n", + "\n", + "import pandas as pd\n", + "import numpy as np\n", + "\n", + "import time\n", + "\n", + "import cantera as ct\n", + "print('Runnning Cantera version: ' + ct.__version__)" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "### Define the gas\n", + "In this example we will choose n-heptane as the gas. For a representative kinetic model, we use the 160 species [mechanism](https://combustion.llnl.gov/archived-mechanisms/alkanes/heptane-reduced-mechanism) by [Seier et al. 2000, Proc. Comb. Inst](http://dx.doi.org/10.1016/S0082-0784(00)80610-4). " + ] + }, + { + "cell_type": "code", + "execution_count": 2, + "metadata": { + "collapsed": false + }, + "outputs": [ + { + "name": "stdout", + "output_type": "stream", + "text": [ + "\n", + "\n", + "**** WARNING ****\n", + "For species c7h15o-1, discontinuity in cp/R detected at Tmid = 1391\n", + "\tValue computed using low-temperature polynomial: 53.0168\n", + "\tValue computed using high-temperature polynomial: 52.748\n", + "\n", + "\n", + "**** WARNING ****\n", + "For species c7h15o-1, discontinuity in h/RT detected at Tmid = 1391\n", + "\tValue computed using low-temperature polynomial: 21.8343\n", + "\tValue computed using high-temperature polynomial: 21.767\n" + ] + } + ], + "source": [ + "gas = ct.Solution('data/seiser.cti')" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "### Define reactor conditions : temperature, pressure, fuel, stoichiometry" + ] + }, + { + "cell_type": "code", + "execution_count": 3, + "metadata": { + "collapsed": false + }, + "outputs": [], + "source": [ + "# Define the reactor temperature and pressure\n", + "reactorTemperature = 1000 #Kelvin\n", + "reactorPressure = 101325.0 #Pascals\n", + "\n", + "gas.TP = reactorTemperature, reactorPressure\n", + "\n", + "# Define the fuel, oxidizer and set the stoichiometry\n", + "gas.set_equivalence_ratio(phi=1.0, fuel='nc7h16', oxidizer={'o2':1.0, 'n2':3.76})\n", + "\n", + "# Create a batch reactor object and add it to a reactor network\n", + "# In this example, the batch reactor will be the only reactor\n", + "# in the network\n", + "r = ct.IdealGasReactor(contents=gas, name='Batch Reactor')\n", + "reactorNetwork = ct.ReactorNet([r])\n", + "\n", + "# now compile a list of all variables for which we will store data\n", + "stateVariableNames = [r.component_name(item) for item in range(r.n_vars)]\n", + "\n", + "# use the above list to create a DataFrame\n", + "timeHistory = pd.DataFrame(columns=stateVariableNames)" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "### Define useful functions" + ] + }, + { + "cell_type": "code", + "execution_count": 4, + "metadata": { + "collapsed": true + }, + "outputs": [], + "source": [ + "def ignitionDelay(df, species):\n", + " \"\"\"\n", + " This function computes the ignition delay from the occurence of the\n", + " peak in species' concentration.\n", + " \"\"\"\n", + " return df[species].argmax()" + ] + }, + { + "cell_type": "code", + "execution_count": 5, + "metadata": { + "collapsed": false + }, + "outputs": [ + { + "name": "stdout", + "output_type": "stream", + "text": [ + "Computed Ignition Delay: 3.248e-02 seconds. Took 1.59s to compute\n" + ] + } + ], + "source": [ + "#Tic\n", + "t0 = time.time()\n", + "\n", + "# This is a starting estimate. If you do not get an ignition within this time, increase it\n", + "estimatedIgnitionDelayTime = 0.1\n", + "t = 0\n", + "\n", + "counter = 1;\n", + "while(t < estimatedIgnitionDelayTime):\n", + " t = reactorNetwork.step()\n", + " if (counter%10 == 0):\n", + " # We will save only every 10th value. Otherwise, this takes too long\n", + " timeHistory.loc[t] = reactorNetwork.get_state()\n", + " counter+=1\n", + "\n", + "# We will use the 'oh' species to compute the ignition delay\n", + "tau = ignitionDelay(timeHistory, 'oh')\n", + "\n", + "#Toc\n", + "t1 = time.time()\n", + "\n", + "print('Computed Ignition Delay: {:.3e} seconds. Took {:3.2f}s to compute'.format(tau, t1-t0))\n", + "\n", + "# If you want to save all the data - molefractions, temperature, pressure, etc\n", + "# uncomment the next line\n", + "# timeHistory.to_csv(\"time_history.csv\")" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "## Plot the result" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "### Import modules and set plotting defaults" + ] + }, + { + "cell_type": "code", + "execution_count": 6, + "metadata": { + "collapsed": false + }, + "outputs": [], + "source": [ + "import matplotlib.pyplot as plt\n", + "import matplotlib as mpl\n", + "%matplotlib notebook\n", + "\n", + "plt.rcParams['axes.labelsize'] = 18\n", + "plt.rcParams['xtick.labelsize'] = 12\n", + "plt.rcParams['ytick.labelsize'] = 12\n", + "plt.rcParams['figure.autolayout'] = True\n", + "\n", + "plt.style.use('ggplot')\n", + "plt.style.use('seaborn-pastel')" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "### Figure illustrating the definition of ignition delay" + ] + }, + { + "cell_type": "code", + "execution_count": 7, + "metadata": { + "collapsed": false + }, + "outputs": [ + { + "data": { + "application/javascript": [ + "/* Put everything inside the global mpl namespace */\n", + "window.mpl = {};\n", + "\n", + "mpl.get_websocket_type = function() {\n", + " if (typeof(WebSocket) !== 'undefined') {\n", + " return WebSocket;\n", + " } else if (typeof(MozWebSocket) !== 'undefined') {\n", + " return MozWebSocket;\n", + " } else {\n", + " alert('Your browser does not have WebSocket support.' +\n", + " 'Please try Chrome, Safari or Firefox ≥ 6. ' +\n", + " 'Firefox 4 and 5 are also supported but you ' +\n", + " 'have to enable WebSockets in about:config.');\n", + " };\n", + "}\n", + "\n", + "mpl.figure = function(figure_id, websocket, ondownload, parent_element) {\n", + " this.id = figure_id;\n", + "\n", + " this.ws = websocket;\n", + "\n", + " this.supports_binary = (this.ws.binaryType != undefined);\n", + "\n", + " if (!this.supports_binary) {\n", + " var warnings = document.getElementById(\"mpl-warnings\");\n", + " if (warnings) {\n", + " warnings.style.display = 'block';\n", + " warnings.textContent = (\n", + " \"This browser does not support binary websocket messages. \" +\n", + " \"Performance may be slow.\");\n", + " }\n", + " }\n", + "\n", + " this.imageObj = new Image();\n", + "\n", + " this.context = undefined;\n", + " this.message = undefined;\n", + " this.canvas = undefined;\n", + " this.rubberband_canvas = undefined;\n", + " this.rubberband_context = undefined;\n", + " this.format_dropdown = undefined;\n", + "\n", + " this.image_mode = 'full';\n", + "\n", + " this.root = $('
');\n", + " this._root_extra_style(this.root)\n", + " this.root.attr('style', 'display: inline-block');\n", + "\n", + " $(parent_element).append(this.root);\n", + "\n", + " this._init_header(this);\n", + " this._init_canvas(this);\n", + " this._init_toolbar(this);\n", + "\n", + " var fig = this;\n", + "\n", + " this.waiting = false;\n", + "\n", + " this.ws.onopen = function () {\n", + " fig.send_message(\"supports_binary\", {value: fig.supports_binary});\n", + " fig.send_message(\"send_image_mode\", {});\n", + " fig.send_message(\"refresh\", {});\n", + " }\n", + "\n", + " this.imageObj.onload = function() {\n", + " if (fig.image_mode == 'full') {\n", + " // Full images could contain transparency (where diff images\n", + " // almost always do), so we need to clear the canvas so that\n", + " // there is no ghosting.\n", + " fig.context.clearRect(0, 0, fig.canvas.width, fig.canvas.height);\n", + " }\n", + " fig.context.drawImage(fig.imageObj, 0, 0);\n", + " };\n", + "\n", + " this.imageObj.onunload = function() {\n", + " this.ws.close();\n", + " }\n", + "\n", + " this.ws.onmessage = this._make_on_message_function(this);\n", + "\n", + " this.ondownload = ondownload;\n", + "}\n", + "\n", + "mpl.figure.prototype._init_header = function() {\n", + " var titlebar = $(\n", + " '
');\n", + " var titletext = $(\n", + " '
');\n", + " titlebar.append(titletext)\n", + " this.root.append(titlebar);\n", + " this.header = titletext[0];\n", + "}\n", + "\n", + "\n", + "\n", + "mpl.figure.prototype._canvas_extra_style = function(canvas_div) {\n", + "\n", + "}\n", + "\n", + "\n", + "mpl.figure.prototype._root_extra_style = function(canvas_div) {\n", + "\n", + "}\n", + "\n", + "mpl.figure.prototype._init_canvas = function() {\n", + " var fig = this;\n", + "\n", + " var canvas_div = $('
');\n", + "\n", + " canvas_div.attr('style', 'position: relative; clear: both; outline: 0');\n", + "\n", + " function canvas_keyboard_event(event) {\n", + " return fig.key_event(event, event['data']);\n", + " }\n", + "\n", + " canvas_div.keydown('key_press', canvas_keyboard_event);\n", + " canvas_div.keyup('key_release', canvas_keyboard_event);\n", + " this.canvas_div = canvas_div\n", + " this._canvas_extra_style(canvas_div)\n", + " this.root.append(canvas_div);\n", + "\n", + " var canvas = $('');\n", + " canvas.addClass('mpl-canvas');\n", + " canvas.attr('style', \"left: 0; top: 0; z-index: 0; outline: 0\")\n", + "\n", + " this.canvas = canvas[0];\n", + " this.context = canvas[0].getContext(\"2d\");\n", + "\n", + " var rubberband = $('');\n", + " rubberband.attr('style', \"position: absolute; left: 0; top: 0; z-index: 1;\")\n", + "\n", + " var pass_mouse_events = true;\n", + "\n", + " canvas_div.resizable({\n", + " start: function(event, ui) {\n", + " pass_mouse_events = false;\n", + " },\n", + " resize: function(event, ui) {\n", + " fig.request_resize(ui.size.width, ui.size.height);\n", + " },\n", + " stop: function(event, ui) {\n", + " pass_mouse_events = true;\n", + " fig.request_resize(ui.size.width, ui.size.height);\n", + " },\n", + " });\n", + "\n", + " function mouse_event_fn(event) {\n", + " if (pass_mouse_events)\n", + " return fig.mouse_event(event, event['data']);\n", + " }\n", + "\n", + " rubberband.mousedown('button_press', mouse_event_fn);\n", + " rubberband.mouseup('button_release', mouse_event_fn);\n", + " // Throttle sequential mouse events to 1 every 20ms.\n", + " rubberband.mousemove('motion_notify', mouse_event_fn);\n", + "\n", + " rubberband.mouseenter('figure_enter', mouse_event_fn);\n", + " rubberband.mouseleave('figure_leave', mouse_event_fn);\n", + "\n", + " canvas_div.on(\"wheel\", function (event) {\n", + " event = event.originalEvent;\n", + " event['data'] = 'scroll'\n", + " if (event.deltaY < 0) {\n", + " event.step = 1;\n", + " } else {\n", + " event.step = -1;\n", + " }\n", + " mouse_event_fn(event);\n", + " });\n", + "\n", + " canvas_div.append(canvas);\n", + " canvas_div.append(rubberband);\n", + "\n", + " this.rubberband = rubberband;\n", + " this.rubberband_canvas = rubberband[0];\n", + " this.rubberband_context = rubberband[0].getContext(\"2d\");\n", + " this.rubberband_context.strokeStyle = \"#000000\";\n", + "\n", + " this._resize_canvas = function(width, height) {\n", + " // Keep the size of the canvas, canvas container, and rubber band\n", + " // canvas in synch.\n", + " canvas_div.css('width', width)\n", + " canvas_div.css('height', height)\n", + "\n", + " canvas.attr('width', width);\n", + " canvas.attr('height', height);\n", + "\n", + " rubberband.attr('width', width);\n", + " rubberband.attr('height', height);\n", + " }\n", + "\n", + " // Set the figure to an initial 600x600px, this will subsequently be updated\n", + " // upon first draw.\n", + " this._resize_canvas(600, 600);\n", + "\n", + " // Disable right mouse context menu.\n", + " $(this.rubberband_canvas).bind(\"contextmenu\",function(e){\n", + " return false;\n", + " });\n", + "\n", + " function set_focus () {\n", + " canvas.focus();\n", + " canvas_div.focus();\n", + " }\n", + "\n", + " window.setTimeout(set_focus, 100);\n", + "}\n", + "\n", + "mpl.figure.prototype._init_toolbar = function() {\n", + " var fig = this;\n", + "\n", + " var nav_element = $('
')\n", + " nav_element.attr('style', 'width: 100%');\n", + " this.root.append(nav_element);\n", + "\n", + " // Define a callback function for later on.\n", + " function toolbar_event(event) {\n", + " return fig.toolbar_button_onclick(event['data']);\n", + " }\n", + " function toolbar_mouse_event(event) {\n", + " return fig.toolbar_button_onmouseover(event['data']);\n", + " }\n", + "\n", + " for(var toolbar_ind in mpl.toolbar_items) {\n", + " var name = mpl.toolbar_items[toolbar_ind][0];\n", + " var tooltip = mpl.toolbar_items[toolbar_ind][1];\n", + " var image = mpl.toolbar_items[toolbar_ind][2];\n", + " var method_name = mpl.toolbar_items[toolbar_ind][3];\n", + "\n", + " if (!name) {\n", + " // put a spacer in here.\n", + " continue;\n", + " }\n", + " var button = $('');\n", + " button.click(method_name, toolbar_event);\n", + " button.mouseover(tooltip, toolbar_mouse_event);\n", + " nav_element.append(button);\n", + " }\n", + "\n", + " // Add the status bar.\n", + " var status_bar = $('');\n", + " nav_element.append(status_bar);\n", + " this.message = status_bar[0];\n", + "\n", + " // Add the close button to the window.\n", + " var buttongrp = $('
');\n", + " var button = $('');\n", + " button.click(function (evt) { fig.handle_close(fig, {}); } );\n", + " button.mouseover('Stop Interaction', toolbar_mouse_event);\n", + " buttongrp.append(button);\n", + " var titlebar = this.root.find($('.ui-dialog-titlebar'));\n", + " titlebar.prepend(buttongrp);\n", + "}\n", + "\n", + "mpl.figure.prototype._root_extra_style = function(el){\n", + " var fig = this\n", + " el.on(\"remove\", function(){\n", + "\tfig.close_ws(fig, {});\n", + " });\n", + "}\n", + "\n", + "mpl.figure.prototype._canvas_extra_style = function(el){\n", + " // this is important to make the div 'focusable\n", + " el.attr('tabindex', 0)\n", + " // reach out to IPython and tell the keyboard manager to turn it's self\n", + " // off when our div gets focus\n", + "\n", + " // location in version 3\n", + " if (IPython.notebook.keyboard_manager) {\n", + " IPython.notebook.keyboard_manager.register_events(el);\n", + " }\n", + " else {\n", + " // location in version 2\n", + " IPython.keyboard_manager.register_events(el);\n", + " }\n", + "\n", + "}\n", + "\n", + "mpl.figure.prototype._key_event_extra = function(event, name) {\n", + " var manager = IPython.notebook.keyboard_manager;\n", + " if (!manager)\n", + " manager = IPython.keyboard_manager;\n", + "\n", + " // Check for shift+enter\n", + " if (event.shiftKey && event.which == 13) {\n", + " this.canvas_div.blur();\n", + " event.shiftKey = false;\n", + " // Send a \"J\" for go to next cell\n", + " event.which = 74;\n", + " event.keyCode = 74;\n", + " manager.command_mode();\n", + " manager.handle_keydown(event);\n", + " }\n", + "}\n", + "\n", + "mpl.figure.prototype.handle_save = function(fig, msg) {\n", + " fig.ondownload(fig, null);\n", + "}\n", + "\n", + "\n", + "mpl.find_output_cell = function(html_output) {\n", + " // Return the cell and output element which can be found *uniquely* in the notebook.\n", + " // Note - this is a bit hacky, but it is done because the \"notebook_saving.Notebook\"\n", + " // IPython event is triggered only after the cells have been serialised, which for\n", + " // our purposes (turning an active figure into a static one), is too late.\n", + " var cells = IPython.notebook.get_cells();\n", + " var ncells = cells.length;\n", + " for (var i=0; i= 3 moved mimebundle to data attribute of output\n", + " data = data.data;\n", + " }\n", + " if (data['text/html'] == html_output) {\n", + " return [cell, data, j];\n", + " }\n", + " }\n", + " }\n", + " }\n", + "}\n", + "\n", + "// Register the function which deals with the matplotlib target/channel.\n", + "// The kernel may be null if the page has been refreshed.\n", + "if (IPython.notebook.kernel != null) {\n", + " IPython.notebook.kernel.comm_manager.register_target('matplotlib', mpl.mpl_figure_comm);\n", + "}\n" + ], + "text/plain": [ + "" + ] + }, + "metadata": {}, + "output_type": "display_data" + }, + { + "data": { + "text/html": [ + "" + ], + "text/plain": [ + "" + ] + }, + "metadata": {}, + "output_type": "display_data" + } + ], + "source": [ + "fig = plt.figure()\n", + "ax = fig.add_subplot(111)\n", + "ax.semilogy(1000/ignitionDelays['T'], ignitionDelays['ignDelay'],'o-')\n", + "ax.set_ylabel('Ignition Delay (s)')\n", + "ax.set_xlabel(r'$\\frac{1000}{T (K)}$', fontsize=18)\n", + "\n", + "# Add a second axis on top to plot the temperature for better readability\n", + "ax2 = ax.twiny()\n", + "ticks = ax.get_xticks()\n", + "ax2.set_xticks(ticks)\n", + "ax2.set_xticklabels((1000/ticks).round(1))\n", + "ax2.set_xlim(ax.get_xlim())\n", + "ax2.set_xlabel(r'Temperature: $T(K)$');" + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": { + "collapsed": true + }, + "outputs": [], + "source": [] + } + ], + "metadata": { + "kernelspec": { + "display_name": "Python 3", + "language": "python", + "name": "python3" + }, + "language_info": { + "codemirror_mode": { + "name": "ipython", + "version": 3 + }, + "file_extension": ".py", + "mimetype": "text/x-python", + "name": "python", + "nbconvert_exporter": "python", + "pygments_lexer": "ipython3", + "version": "3.5.2" + } + }, + "nbformat": 4, + "nbformat_minor": 0 +} diff --git a/reactors/data/seiser.cti b/reactors/data/seiser.cti new file mode 100644 index 0000000..4b6ba06 --- /dev/null +++ b/reactors/data/seiser.cti @@ -0,0 +1,7431 @@ +""" +Seiser, H., Pitsch, H., Seshadri, K., Pitz, W.J., and Curran, H. J., +"Extinction and Autoignition of n-Heptane in Counterflow Configuration", +Proceedings of the Combustion Institute, Volume 28, p. 2029-2037, 2000. + UCRL-WEB-204236 + Review and release date: May 19, 2004. + +Seiser, H., Pitsch, H., Seshadri, K., Pitz, W.J., and Curran, H. J., +"Extinction and Autoignition of n-Heptane in Counterflow Configuration", +Proceedings of the Combustion Institute, Volume 28, p. 2029-2037, 2000. + UCRL-WEB-204236 + Review and release date: May 19, 2004. + +""" + +units(length='cm', time='s', quantity='mol', act_energy='cal/mol') + +ideal_gas(name='gas', + elements="N C H O", + species="""n2 ch3 h + ch4 h2 oh + h2o o c2h6 + c2h5 hco co + co2 o2 h2o2 + ho2 c2h4 ch3oh + ch2oh ch3o ch2o + c2h2 c2h3 c2h + hcco ch2 ch + ch2co ch2(s) pc2h4oh + ch3co ch3cho c3h5-s + c3h4-p c3h5-a c3h6 + c3h4-a ch3chco c3h5-t + c4h6 nc3h7 ic3h7 + c3h8 c5h9 c4h7 + c4h8-1 sc4h9 pc4h9 + ch3coch3 ch3coch2 c2h5co + c2h5cho c5h10-1 ch2cho + c5h11-1 c5h11-2 c2h5o + c2h5o2 ch3o2 ch3o2h + c3h2 o2c2h4oh c2h4o2h + c2h3co c2h3cho c3h5o + c3h6o1-2 c3h6ooh1-2 c3h6ooh2-1 + nc3h7o ic3h7o nc3h7o2 + ic3h7o2 c4h7o c4h8ooh1-3o2 + c4h8ooh1-3 nc4ket13 c4h8ooh1-2 + c4h8o1-3 pc4h9o2 c3h3 + hocho c2h3o1,2 nc3h7cho + nc3h7co c3h6cho-2 ch2ch2coch3 + c2h5coch2 c2h5coc2h4p nc3h7coch2 + nc4h9cho nc4h9co hoch2o + c6h13-1 c6h12-1 c6h11 + nc7h16 c7h15-1 c7h15-2 + c7h15-3 c7h15-4 c7h15o2-1 + c7h15o2h-1 c7h15o2-2 c7h15o2h-2 + c7h15o2-3 c7h15o2h-3 c7h14-1 + c7h14-2 c7h14-3 c7h13 + c7h15o2-4 c7h15o-1 c7h15o-2 + c7h15o-3 c7h14ooh1-2 c7h14ooh1-3 + c7h14ooh1-4 c7h14ooh2-3 c7h14ooh2-4 + c7h14ooh2-5 c7h14ooh3-1 c7h14ooh3-2 + c7h14ooh3-4 c7h14ooh3-5 c7h14ooh3-6 + c7h14ooh4-2 c7h14ooh4-3 c7h14o1-3 + c7h14o1-4 c7h14o2-4 c7h14o2-5 + c7h14o3-5 c7h14ooh1-3o2 c7h14ooh2-3o2 + c7h14ooh2-4o2 c7h14ooh2-5o2 c7h14ooh3-1o2 + c7h14ooh3-2o2 c7h14ooh3-4o2 c7h14ooh3-5o2 + c7h14ooh3-6o2 c7h14ooh4-2o2 c7h14ooh4-3o2 + nc7ket13 nc7ket23 nc7ket24 + nc7ket25 nc7ket31 nc7ket32 + nc7ket34 nc7ket35 nc7ket36 + nc7ket42 nc7ket43 nc4h9coch2 + c4h7ooh1-4 c5h9ooh1-4 c4h7o1-4 + c5h9o1-4""", + reactions='all', + transport='Mix', + initial_state=state(temperature=300.0, pressure=OneAtm)) + +#------------------------------------------------------------------------------- +# Species data +#------------------------------------------------------------------------------- + +species(name=u'n2', + atoms='N:2', + thermo=(NASA([300.00, 1000.00], + [ 3.29867700E+00, 1.40824000E-03, -3.96322200E-06, + 5.64151500E-09, -2.44485500E-12, -1.02090000E+03, + 3.95037200E+00]), + NASA([1000.00, 5000.00], + [ 2.92664000E+00, 1.48797700E-03, -5.68476100E-07, + 1.00970400E-10, -6.75335100E-15, -9.22797700E+02, + 5.98052800E+00])), + transport=gas_transport(geom='linear', + diam=3.621, + well_depth=97.53, + polar=1.76, + rot_relax=4.0), + note=u'121286') + +species(name=u'ch3', + atoms='H:3 C:1', + thermo=(NASA([300.00, 1000.00], + [ 2.43044300E+00, 1.11241000E-02, -1.68022000E-05, + 1.62182900E-08, -5.86495300E-12, 1.64237800E+04, + 6.78979400E+00]), + NASA([1000.00, 5000.00], + [ 2.84405200E+00, 6.13797400E-03, -2.23034500E-06, + 3.78516100E-10, -2.45215900E-14, 1.64378100E+04, + 5.45269700E+00])), + transport=gas_transport(geom='linear', + diam=3.8, + well_depth=144.0), + note=u'121286') + +species(name=u'h', + atoms='H:1', + thermo=(NASA([300.00, 1000.00], + [ 2.50000000E+00, 0.00000000E+00, 0.00000000E+00, + 0.00000000E+00, 0.00000000E+00, 2.54716300E+04, + -4.60117600E-01]), + NASA([1000.00, 5000.00], + [ 2.50000000E+00, 0.00000000E+00, 0.00000000E+00, + 0.00000000E+00, 0.00000000E+00, 2.54716300E+04, + -4.60117600E-01])), + transport=gas_transport(geom='atom', + diam=2.05, + well_depth=145.0), + note=u'120186') + +species(name=u'ch4', + atoms='H:4 C:1', + thermo=(NASA([300.00, 1000.00], + [ 7.78741500E-01, 1.74766800E-02, -2.78340900E-05, + 3.04970800E-08, -1.22393100E-11, -9.82522900E+03, + 1.37221900E+01]), + NASA([1000.00, 5000.00], + [ 1.68347900E+00, 1.02372400E-02, -3.87512900E-06, + 6.78558500E-10, -4.50342300E-14, -1.00807900E+04, + 9.62339500E+00])), + transport=gas_transport(geom='nonlinear', + diam=3.746, + well_depth=141.4, + polar=2.6, + rot_relax=13.0), + note=u'121286') + +species(name=u'h2', + atoms='H:2', + thermo=(NASA([300.00, 1000.00], + [ 3.29812400E+00, 8.24944200E-04, -8.14301500E-07, + -9.47543400E-11, 4.13487200E-13, -1.01252100E+03, + -3.29409400E+00]), + NASA([1000.00, 5000.00], + [ 2.99142300E+00, 7.00064400E-04, -5.63382900E-08, + -9.23157800E-12, 1.58275200E-15, -8.35034000E+02, + -1.35511000E+00])), + transport=gas_transport(geom='linear', + diam=2.92, + well_depth=38.0, + polar=0.79, + rot_relax=280.0), + note=u'121286') + +species(name=u'oh', + atoms='H:1 O:1', + thermo=(NASA([300.00, 1357.00], + [ 3.43586219E+00, 2.02235804E-04, -1.13546412E-07, + 2.42445149E-10, -7.43651031E-14, 3.74321252E+03, + 2.45014127E+00]), + NASA([1357.00, 5000.00], + [ 2.62599754E+00, 1.31992406E-03, -3.59724670E-07, + 4.25630800E-11, -1.82048016E-15, 4.12085374E+03, + 7.10667307E+00])), + transport=gas_transport(geom='linear', + diam=2.75, + well_depth=80.0), + note=u'8/12/99therm') + +species(name=u'h2o', + atoms='H:2 O:1', + thermo=(NASA([300.00, 1000.00], + [ 3.38684200E+00, 3.47498200E-03, -6.35469600E-06, + 6.96858100E-09, -2.50658800E-12, -3.02081100E+04, + 2.59023300E+00]), + NASA([1000.00, 5000.00], + [ 2.67214600E+00, 3.05629300E-03, -8.73026000E-07, + 1.20099600E-10, -6.39161800E-15, -2.98992100E+04, + 6.86281700E+00])), + transport=gas_transport(geom='nonlinear', + diam=2.605, + well_depth=572.4, + dipole=1.844, + rot_relax=4.0), + note=u'20387') + +species(name=u'o', + atoms='O:1', + thermo=(NASA([300.00, 1000.00], + [ 2.94642900E+00, -1.63816600E-03, 2.42103200E-06, + -1.60284300E-09, 3.89069600E-13, 2.91476400E+04, + 2.96399500E+00]), + NASA([1000.00, 5000.00], + [ 2.54206000E+00, -2.75506200E-05, -3.10280300E-09, + 4.55106700E-12, -4.36805200E-16, 2.92308000E+04, + 4.92030800E+00])), + transport=gas_transport(geom='atom', + diam=2.75, + well_depth=80.0), + note=u'120186') + +species(name=u'c2h6', + atoms='H:6 C:2', + thermo=(NASA([300.00, 1384.00], + [-2.52854344E-02, 2.40764754E-02, -1.11893472E-05, + 2.08340901E-09, -5.29868616E-14, -1.12345534E+04, + 2.11648750E+01]), + NASA([1384.00, 5000.00], + [ 6.10683385E+00, 1.29236361E-02, -4.42527196E-06, + 6.87391726E-10, -3.98901732E-14, -1.37500014E+04, + -1.30081250E+01])), + transport=gas_transport(geom='nonlinear', + diam=4.35, + well_depth=247.5, + rot_relax=1.5), + note=u'1/14/95therm') + +species(name=u'c2h5', + atoms='H:5 C:2', + thermo=(NASA([300.00, 1000.00], + [ 2.69070200E+00, 8.71913300E-03, 4.41983900E-06, + 9.33870300E-10, -3.92777300E-12, 1.28704000E+04, + 1.21382000E+01]), + NASA([1000.00, 5000.00], + [ 7.19048000E+00, 6.48407700E-03, -6.42806500E-07, + -2.34787900E-10, 3.88087700E-14, 1.06745500E+04, + -1.47808900E+01])), + transport=gas_transport(geom='nonlinear', + diam=4.35, + well_depth=247.5, + rot_relax=1.5), + note=u'12387') + +species(name=u'hco', + atoms='H:1 C:1 O:1', + thermo=(NASA([300.00, 1000.00], + [ 2.89833000E+00, 6.19914700E-03, -9.62308400E-06, + 1.08982500E-08, -4.57488500E-12, 4.15992200E+03, + 8.98361400E+00]), + NASA([1000.00, 5000.00], + [ 3.55727100E+00, 3.34557300E-03, -1.33500600E-06, + 2.47057300E-10, -1.71385100E-14, 3.91632400E+03, + 5.55229900E+00])), + transport=gas_transport(geom='nonlinear', + diam=3.59, + well_depth=498.0), + note=u'121286') + +species(name=u'co', + atoms='C:1 O:1', + thermo=(NASA([300.00, 1000.00], + [ 3.26245200E+00, 1.51194100E-03, -3.88175500E-06, + 5.58194400E-09, -2.47495100E-12, -1.43105400E+04, + 4.84889700E+00]), + NASA([1000.00, 5000.00], + [ 3.02507800E+00, 1.44268900E-03, -5.63082800E-07, + 1.01858100E-10, -6.91095200E-15, -1.42683500E+04, + 6.10821800E+00])), + transport=gas_transport(geom='linear', + diam=3.65, + well_depth=98.1, + polar=1.95, + rot_relax=1.8), + note=u'121286') + +species(name=u'co2', + atoms='C:1 O:2', + thermo=(NASA([300.00, 1000.00], + [ 2.27572500E+00, 9.92207200E-03, -1.04091100E-05, + 6.86668700E-09, -2.11728000E-12, -4.83731400E+04, + 1.01884900E+01]), + NASA([1000.00, 5000.00], + [ 4.45362300E+00, 3.14016900E-03, -1.27841100E-06, + 2.39399700E-10, -1.66903300E-14, -4.89669600E+04, + -9.55395900E-01])), + transport=gas_transport(geom='linear', + diam=3.763, + well_depth=244.0, + polar=2.65, + rot_relax=2.1), + note=u'121286') + +species(name=u'o2', + atoms='O:2', + thermo=(NASA([300.00, 1000.00], + [ 3.21293600E+00, 1.12748600E-03, -5.75615000E-07, + 1.31387700E-09, -8.76855400E-13, -1.00524900E+03, + 6.03473800E+00]), + NASA([1000.00, 5000.00], + [ 3.69757800E+00, 6.13519700E-04, -1.25884200E-07, + 1.77528100E-11, -1.13643500E-15, -1.23393000E+03, + 3.18916600E+00])), + transport=gas_transport(geom='linear', + diam=3.458, + well_depth=107.4, + polar=1.6, + rot_relax=3.8), + note=u'121386') + +species(name=u'h2o2', + atoms='H:2 O:2', + thermo=(NASA([300.00, 1000.00], + [ 3.38875400E+00, 6.56922600E-03, -1.48501300E-07, + -4.62580600E-09, 2.47151500E-12, -1.76631500E+04, + 6.78536300E+00]), + NASA([1000.00, 5000.00], + [ 4.57316700E+00, 4.33613600E-03, -1.47468900E-06, + 2.34890400E-10, -1.43165400E-14, -1.80069600E+04, + 5.01137000E-01])), + transport=gas_transport(geom='nonlinear', + diam=3.458, + well_depth=107.4, + rot_relax=3.8), + note=u'120186') + +species(name=u'ho2', + atoms='H:1 O:2', + thermo=(NASA([300.00, 1390.00], + [ 3.18310656E+00, 3.66767950E-03, -9.32385122E-07, + -3.25852919E-10, 1.51139912E-13, 8.09181013E+02, + 8.39371099E+00]), + NASA([1390.00, 5000.00], + [ 4.10547423E+00, 2.38452835E-03, -8.06347989E-07, + 1.24191723E-10, -7.16400108E-15, 3.98127689E+02, + 3.12515836E+00])), + transport=gas_transport(geom='nonlinear', + diam=3.458, + well_depth=107.4, + rot_relax=1.0), + note=u'8/12/99therm') + +species(name=u'c2h4', + atoms='H:4 C:2', + thermo=(NASA([300.00, 1000.00], + [-8.61488000E-01, 2.79616300E-02, -3.38867700E-05, + 2.78515200E-08, -9.73787900E-12, 5.57304600E+03, + 2.42114900E+01]), + NASA([1000.00, 5000.00], + [ 3.52841900E+00, 1.14851800E-02, -4.41838500E-06, + 7.84460100E-10, -5.26684800E-14, 4.42828900E+03, + 2.23038900E+00])), + transport=gas_transport(geom='nonlinear', + diam=3.496, + well_depth=238.4, + rot_relax=1.5), + note=u'121286') + +species(name=u'ch3oh', + atoms='H:4 C:1 O:1', + thermo=(NASA([300.00, 1000.00], + [ 2.66011500E+00, 7.34150800E-03, 7.17005100E-06, + -8.79319400E-09, 2.39057000E-12, -2.53534800E+04, + 1.12326300E+01]), + NASA([1000.00, 5000.00], + [ 4.02906100E+00, 9.37659300E-03, -3.05025400E-06, + 4.35879300E-10, -2.22472300E-14, -2.61579100E+04, + 2.37819600E+00])), + transport=gas_transport(geom='nonlinear', + diam=3.626, + well_depth=481.8, + rot_relax=1.0), + note=u'121686') + +species(name=u'ch2oh', + atoms='H:3 C:1 O:1', + thermo=(NASA([250.00, 1000.00], + [ 2.86262800E+00, 1.00152700E-02, -5.28543600E-07, + -5.13854000E-09, 2.24604100E-12, -3.34967900E+03, + 1.03979400E+01]), + NASA([1000.00, 4000.00], + [ 6.32752000E+00, 3.60827100E-03, -3.20154700E-07, + -1.93875000E-10, 3.50970500E-14, -4.47450900E+03, + -8.32936600E+00])), + transport=gas_transport(geom='nonlinear', + diam=3.69, + well_depth=417.0, + dipole=1.7, + rot_relax=2.0), + note=u'120186') + +species(name=u'ch3o', + atoms='H:3 C:1 O:1', + thermo=(NASA([300.00, 1000.00], + [ 2.10620400E+00, 7.21659500E-03, 5.33847200E-06, + -7.37763600E-09, 2.07561100E-12, 9.78601100E+02, + 1.31521800E+01]), + NASA([1000.00, 3000.00], + [ 3.77080000E+00, 7.87149700E-03, -2.65638400E-06, + 3.94443100E-10, -2.11261600E-14, 1.27832500E+02, + 2.92957500E+00])), + transport=gas_transport(geom='nonlinear', + diam=3.69, + well_depth=417.0, + dipole=1.7, + rot_relax=2.0), + note=u'121686') + +species(name=u'ch2o', + atoms='H:2 C:1 O:1', + thermo=(NASA([300.00, 1000.00], + [ 1.65273100E+00, 1.26314400E-02, -1.88816800E-05, + 2.05003100E-08, -8.41323700E-12, -1.48654000E+04, + 1.37848200E+01]), + NASA([1000.00, 5000.00], + [ 2.99560600E+00, 6.68132100E-03, -2.62895500E-06, + 4.73715300E-10, -3.21251700E-14, -1.53203700E+04, + 6.91257200E+00])), + transport=gas_transport(geom='nonlinear', + diam=3.59, + well_depth=498.0, + rot_relax=2.0), + note=u'121286') + +species(name=u'c2h2', + atoms='H:2 C:2', + thermo=(NASA([300.00, 1000.00], + [ 2.01356200E+00, 1.51904500E-02, -1.61631900E-05, + 9.07899200E-09, -1.91274600E-12, 2.61244400E+04, + 8.80537800E+00]), + NASA([1000.00, 5000.00], + [ 4.43677000E+00, 5.37603900E-03, -1.91281700E-06, + 3.28637900E-10, -2.15671000E-14, 2.56676600E+04, + -2.80033800E+00])), + transport=gas_transport(geom='linear', + diam=3.721, + well_depth=265.3, + rot_relax=2.5), + note=u'121386') + +species(name=u'c2h3', + atoms='H:3 C:2', + thermo=(NASA([300.00, 1000.00], + [ 2.45927600E+00, 7.37147600E-03, 2.10987300E-06, + -1.32164200E-09, -1.18478400E-12, 3.33522500E+04, + 1.15562000E+01]), + NASA([1000.00, 5000.00], + [ 5.93346800E+00, 4.01774600E-03, -3.96674000E-07, + -1.44126700E-10, 2.37864400E-14, 3.18543500E+04, + -8.53031300E+00])), + transport=gas_transport(geom='nonlinear', + diam=3.721, + well_depth=265.3, + rot_relax=1.0), + note=u'12787') + +species(name=u'c2h', + atoms='H:1 C:2', + thermo=(NASA([300.00, 1000.00], + [ 2.73770400E+00, 8.04844600E-03, -9.24431000E-06, + 6.52525900E-09, -1.93958000E-12, 6.68381300E+04, + 7.30022000E+00]), + NASA([1000.00, 4000.00], + [ 3.98636700E+00, 3.14312300E-03, -1.26724300E-06, + 2.92436300E-10, -2.71632000E-14, 6.65588400E+04, + 1.19106300E+00])), + transport=gas_transport(geom='linear', + diam=3.721, + well_depth=265.3, + rot_relax=2.5), + note=u'81193') + +species(name=u'hcco', + atoms='H:1 C:2 O:1', + thermo=(NASA([300.00, 1000.00], + [ 5.04796500E+00, 4.45347800E-03, 2.26828300E-07, + -1.48209500E-09, 2.25074200E-13, 1.96589200E+04, + 4.81843900E-01]), + NASA([1000.00, 4000.00], + [ 6.75807300E+00, 2.00040000E-03, -2.02760700E-07, + -1.04113200E-10, 1.96516500E-14, 1.90151300E+04, + -9.07126200E+00])), + transport=gas_transport(geom='nonlinear', + diam=2.5, + well_depth=150.0, + rot_relax=1.0), + note=u'32387') + +species(name=u'ch2', + atoms='H:2 C:1', + thermo=(NASA([250.00, 1000.00], + [ 3.76223700E+00, 1.15981900E-03, 2.48958500E-07, + 8.80083600E-10, -7.33243500E-13, 4.53679100E+04, + 1.71257800E+00]), + NASA([1000.00, 4000.00], + [ 3.63640800E+00, 1.93305700E-03, -1.68701600E-07, + -1.00989900E-10, 1.80825600E-14, 4.53413400E+04, + 2.15656100E+00])), + transport=gas_transport(geom='linear', + diam=3.8, + well_depth=144.0), + note=u'120186') + +species(name=u'ch', + atoms='H:1 C:1', + thermo=(NASA([300.00, 1000.00], + [ 3.20020200E+00, 2.07287600E-03, -5.13443100E-06, + 5.73389000E-09, -1.95553300E-12, 7.04525900E+04, + 3.33158800E+00]), + NASA([1000.00, 5000.00], + [ 2.19622300E+00, 2.34038100E-03, -7.05820100E-07, + 9.00758200E-11, -3.85504000E-15, 7.08672300E+04, + 9.17837300E+00])), + transport=gas_transport(geom='linear', + diam=2.75, + well_depth=80.0), + note=u'121286') + +species(name=u'ch2co', + atoms='H:2 C:2 O:1', + thermo=(NASA([300.00, 1000.00], + [ 2.97497100E+00, 1.21187100E-02, -2.34504600E-06, + -6.46668500E-09, 3.90564900E-12, -7.63263700E+03, + 8.67355300E+00]), + NASA([1000.00, 5000.00], + [ 6.03881700E+00, 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2.52406370E-02, -8.72522623E-06, + 1.36422047E-09, -7.95374883E-14, -2.20531958E+04, + -7.71140999E+01])), + transport=gas_transport(geom='nonlinear', + diam=5.625, + well_depth=534.323), + note=u'2/22/96therm') + +species(name=u'c4h7ooh1-4', + atoms='H:8 C:4 O:2', + thermo=(NASA([300.00, 1393.00], + [ 1.79804670E+00, 5.23302551E-02, -3.64638246E-05, + 1.31971888E-08, -1.97165993E-12, -1.32846748E+04, + 2.25862038E+01]), + NASA([1393.00, 5000.00], + [ 1.66978343E+01, 1.80578399E-02, -6.22476839E-06, + 9.71479434E-10, -5.65686551E-14, -1.85344720E+04, + -5.76609547E+01])), + transport=gas_transport(geom='nonlinear', + diam=5.664, + well_depth=523.2, + dipole=1.7, + rot_relax=1.0), + note=u'4/1/96therm') + +species(name=u'c5h9ooh1-4', + atoms='H:10 C:5 O:2', + thermo=(NASA([300.00, 1397.00], + [ 7.67782330E-01, 6.93519317E-02, -5.21650213E-05, + 2.06237355E-08, -3.35844189E-12, -1.78318101E+04, + 2.80373555E+01]), + NASA([1397.00, 5000.00], + [ 2.02179950E+01, 2.21511744E-02, -7.60711244E-06, + 1.18420679E-09, -6.88331594E-14, -2.44297406E+04, + -7.58287543E+01])), + transport=gas_transport(geom='nonlinear', + diam=5.68, + well_depth=543.585), + note=u'3/27/97therm') + +species(name=u'c4h7o1-4', + atoms='H:7 C:4 O:1', + thermo=(NASA([300.00, 1393.00], + [-2.92647947E-01, 4.83149119E-02, -3.48133220E-05, + 1.31921468E-08, -2.06485553E-12, 6.29978883E+03, + 3.03629978E+01]), + NASA([1393.00, 5000.00], + [ 1.31417783E+01, 1.64166051E-02, -5.56949199E-06, + 8.60114769E-10, -4.97230006E-14, 1.67967537E+03, + -4.16160087E+01])), + transport=gas_transport(geom='nonlinear', + diam=5.778, + well_depth=476.0, + dipole=2.6, + rot_relax=1.0), + note=u'4/1/96therm') + +species(name=u'c5h9o1-4', + atoms='H:9 C:5 O:1', + thermo=(NASA([300.00, 1398.00], + [-8.53018802E-01, 6.41880432E-02, -4.91931508E-05, + 2.00188214E-08, -3.35963237E-12, 1.19509504E+03, + 3.38333616E+01]), + NASA([1398.00, 5000.00], + [ 1.66809382E+01, 2.07591828E-02, -7.09289768E-06, + 1.10031617E-09, -6.37992567E-14, -4.67568455E+03, + -5.95056483E+01])), + transport=gas_transport(geom='nonlinear', + diam=5.348, + well_depth=489.084), + note=u'3/28/97therm') + +#------------------------------------------------------------------------------- +# Reaction data +#------------------------------------------------------------------------------- + +# Reaction 1 +falloff_reaction('ch3 + h (+ M) => ch4 (+ M)', + kf=[2.140000e+15, -0.4, 0.0], + kf0=[3.310000e+30, -4.0, 2108.03], + efficiencies='h2:2.0 h2o:5.0 co2:3.0 co:2.0', + falloff=Troe(A=0.0, T3=1e-15, T1=1e-15, T2=40.0)) + +# Reaction 2 +falloff_reaction('ch4 (+ M) => ch3 + h (+ M)', + kf=[1.054000e+21, -1.4, 107900.1], + kf0=[1.630000e+36, -5.0, 110008.13], + efficiencies='h2:2.0 h2o:5.0 co2:3.0 co:2.0', + falloff=Troe(A=0.0, T3=1e-15, T1=1e-15, T2=40.0)) + +# Reaction 3 +reaction('ch4 + h => ch3 + h2', [1.727000e+04, 3.0, 8223.95]) + +# Reaction 4 +reaction('ch3 + h2 => ch4 + h', [6.610000e+02, 3.0, 7744.02]) + +# Reaction 5 +reaction('ch4 + oh => ch3 + h2o', [1.930000e+05, 2.4, 2106.12]) + +# Reaction 6 +reaction('ch3 + h2o => ch4 + oh', [4.820000e+02, 2.9, 14859.94]) + +# Reaction 7 +reaction('ch4 + o => ch3 + oh', [2.130000e+06, 2.21, 6479.92]) + +# Reaction 8 +reaction('ch3 + oh => ch4 + o', [3.557000e+04, 2.21, 3919.93]) + +# Reaction 9 +reaction('c2h6 + ch3 => c2h5 + ch4', [1.510000e-07, 6.0, 6047.08]) + +# Reaction 10 +reaction('c2h5 + ch4 => c2h6 + ch3', [9.649000e-10, 6.56, 10219.89]) + +# Reaction 11 +reaction('hco + oh => co + h2o', [1.020000e+14, 0.0, 0.0]) + +# Reaction 12 +reaction('co + h2o => hco + oh', [2.896000e+15, 0.0, 105200.05]) + +# Reaction 13 +reaction('co + oh => co2 + h', [1.400000e+05, 1.95, -1347.04]) + +# Reaction 14 +reaction('co2 + h => co + oh', [1.568000e+07, 1.95, 20989.96]) + +# Reaction 15 +reaction('h + o2 => o + oh', [1.970000e+14, 0.0, 16539.91]) + +# Reaction 16 +reaction('o + oh => h + o2', [1.555000e+13, 0.0, 424.95]) + +# Reaction 17 +reaction('o + h2 => h + oh', [5.080000e+04, 2.67, 6292.07]) + +# Reaction 18 +reaction('h + oh => o + h2', [2.231000e+04, 2.67, 4196.94]) + +# Reaction 19 +reaction('o + h2o => 2 oh', [2.970000e+06, 2.02, 13400.1]) + +# Reaction 20 +reaction('2 oh => o + h2o', [3.013000e+05, 2.02, -3849.9]) + +# Reaction 21 +reaction('oh + h2 => h + h2o', [2.160000e+08, 1.51, 3429.97]) + +# Reaction 22 +reaction('h + h2o => oh + h2', [9.352000e+08, 1.51, 18580.07]) + +# Reaction 23 +three_body_reaction('hco + M => h + co + M', [1.860000e+17, -1.0, 17000.0], + efficiencies='h2:2.5 h2o:12.0 co2:3.8 co:1.9') + +# Reaction 24 +three_body_reaction('h + co + M => hco + M', [6.467000e+13, 0.0, -441.92], + efficiencies='h2:2.5 h2o:12.0 co2:3.8 co:1.9') + +# Reaction 25 +reaction('h2o2 + oh => h2o + ho2', [1.000000e+12, 0.0, 0.0], + options='duplicate') + +# Reaction 26 +reaction('h2o + ho2 => h2o2 + oh', [1.685000e+11, 0.33, 31460.09], + options='duplicate') + +# Reaction 27 +reaction('c2h4 + o => ch3 + hco', [1.020000e+07, 1.88, 179.02]) + +# Reaction 28 +reaction('ch3 + hco => c2h4 + o', [2.851000e+08, 1.05, 31770.08]) + +# Reaction 29 +falloff_reaction('h + c2h4 (+ M) => c2h5 (+ M)', + kf=[1.081000e+12, 0.45, 1821.94], + kf0=[1.112000e+34, -5.0, 4447.9], + efficiencies='h2:2.0 h2o:5.0 co2:3.0 co:2.0', + falloff=Troe(A=1.0, T3=1e-15, T1=95.0, T2=200.0)) + +# Reaction 30 +falloff_reaction('c2h5 (+ M) => h + c2h4 (+ M)', + kf=[3.587000e+14, -0.34, 39570.03], + kf0=[3.690000e+36, -5.79, 42195.98], + efficiencies='h2:2.0 h2o:5.0 co2:3.0 co:2.0', + falloff=Troe(A=1.0, T3=1e-15, T1=95.0, T2=200.0)) + +# Reaction 31 +falloff_reaction('ch3oh (+ M) => ch3 + oh (+ M)', + kf=[1.900000e+16, 0.0, 91729.92], + kf0=[2.950000e+44, -7.35, 95460.09], + efficiencies='h2:2.0 h2o:16.0 co2:3.0 co:2.0', + falloff=Troe(A=0.414, T3=279.0, T1=5459.0, T2=1e+100)) + +# Reaction 32 +falloff_reaction('ch3 + oh (+ M) => ch3oh (+ M)', + kf=[9.181000e+10, 1.0, 744.98], + kf0=[1.425000e+39, -6.35, 4475.14], + efficiencies='h2:2.0 h2o:16.0 co2:3.0 co:2.0', + falloff=Troe(A=0.414, T3=279.0, T1=5459.0, T2=1e+100)) + +# Reaction 33 +reaction('c2h6 + h => c2h5 + h2', [5.540000e+02, 3.5, 5167.07]) + +# Reaction 34 +reaction('c2h5 + h2 => c2h6 + h', [1.355000e-01, 4.06, 8857.07]) + +# Reaction 35 +reaction('ch3oh + ho2 => ch2oh + h2o2', [3.980000e+13, 0.0, 19400.1]) + +# Reaction 36 +reaction('ch2oh + h2o2 => ch3oh + ho2', [3.130000e+15, -0.9, 10750.0]) + +# Reaction 37 +reaction('c2h5 + o2 => c2h4 + ho2', [1.220000e+30, -5.76, 10099.9]) + +# Reaction 38 +reaction('c2h4 + ho2 => c2h5 + o2', [1.259000e+30, -5.63, 22309.99]) + +# Reaction 39 +reaction('c2h6 + oh => c2h5 + h2o', [5.125000e+06, 2.06, 854.92]) + +# Reaction 40 +reaction('c2h5 + h2o => c2h6 + oh', [1.010000e+07, 2.06, 22979.92]) + +# Reaction 41 +reaction('c2h6 + o => c2h5 + oh', [1.130000e+14, 0.0, 7849.9]) + +# Reaction 42 +reaction('c2h5 + oh => c2h6 + o', [2.080000e+13, 0.0, 12719.89]) + +# Reaction 43 +reaction('ch3 + ho2 => ch3o + oh', [1.100000e+13, 0.0, 0.0]) + +# Reaction 44 +reaction('ch3o + oh => ch3 + ho2', [4.780000e+14, -0.35, 24549.95]) + +# Reaction 45 +reaction('co + ho2 => co2 + oh', [3.010000e+13, 0.0, 23000.0]) + +# Reaction 46 +reaction('co2 + oh => co + ho2', [6.435000e+15, -0.33, 84609.94]) + +# Reaction 47 +falloff_reaction('2 ch3 (+ M) => c2h6 (+ M)', + kf=[9.214000e+16, -1.17, 635.76], + kf0=[1.135000e+36, -5.246, 1705.07], + efficiencies='h2:2.0 h2o:5.0 co2:3.0 co:2.0', + falloff=Troe(A=0.405, T3=1120.0, T1=69.6, T2=1e+15)) + +# Reaction 48 +falloff_reaction('c2h6 (+ M) => 2 ch3 (+ M)', + kf=[4.709000e+21, -1.7, 87409.89], + kf0=[5.801000e+40, -5.776, 88479.21], + efficiencies='h2:2.0 h2o:5.0 co2:3.0 co:2.0', + falloff=Troe(A=0.405, T3=1120.0, T1=69.6, T2=1e+15)) + +# Reaction 49 +three_body_reaction('h2o + M => h + oh + M', [1.837000e+27, -3.0, 122599.9], + efficiencies='h2:2.5 h2o:12.0 co2:3.8 co:1.9') + +# Reaction 50 +three_body_reaction('h + oh + M => h2o + M', [2.250000e+22, -2.0, 0.0], + efficiencies='h2:2.5 h2o:12.0 co2:3.8 co:1.9') + +# Reaction 51 +falloff_reaction('h + o2 (+ M) => ho2 (+ M)', + kf=[1.475000e+12, 0.6, 0.0], + kf0=[3.500000e+16, -0.41, -1115.92], + efficiencies='h2:2.5 h2o:12.0 co2:3.8 co:1.9', + falloff=Troe(A=0.5, T3=1e-30, T1=1e+30, T2=1e+100)) + +# Reaction 52 +falloff_reaction('ho2 (+ M) => h + o2 (+ M)', + kf=[5.053000e+14, -0.07, 49960.09], + kf0=[1.199000e+19, -1.08, 48844.17], + efficiencies='h2:2.5 h2o:12.0 co2:3.8 co:1.9', + falloff=Troe(A=0.5, T3=1e-30, T1=1e+30, T2=1e+100)) + +# Reaction 53 +falloff_reaction('co + o (+ M) => co2 (+ M)', + kf=[1.800000e+10, 0.0, 2384.08], + kf0=[1.350000e+24, -2.788, 4190.97], + efficiencies='h2:2.5 h2o:12.0 co2:3.8 co:1.9') + +# Reaction 54 +three_body_reaction('co2 + M => co + o + M', [1.670000e+16, -1.0, 130099.9], + efficiencies='h2:2.5 h2o:12.0 co2:3.8 co:1.9') + +# Reaction 55 +reaction('co + o2 => co2 + o', [1.068000e-15, 7.13, 13320.03]) + +# Reaction 56 +reaction('co2 + o => co + o2', [9.444000e-15, 7.13, 19539.91]) + +# Reaction 57 +reaction('hco + h => co + h2', [7.340000e+13, 0.0, 0.0]) + +# Reaction 58 +reaction('co + h2 => hco + h', [4.813000e+14, 0.0, 90000.0]) + +# Reaction 59 +reaction('hco + o => co + oh', [3.020000e+13, 0.0, 0.0]) + +# Reaction 60 +reaction('co + oh => hco + o', [8.697000e+13, 0.0, 87900.1]) + +# Reaction 61 +three_body_reaction('ch2o + M => hco + h + M', [6.283000e+29, -3.57, 93200.05]) + +# Reaction 62 +three_body_reaction('hco + h + M => ch2o + M', [2.660000e+24, -2.57, 427.1]) + +# Reaction 63 +reaction('ch2o + oh => hco + h2o', [3.430000e+09, 1.18, -446.94]) + +# Reaction 64 +reaction('hco + h2o => ch2o + oh', [1.186000e+09, 1.18, 29380.02]) + +# Reaction 65 +reaction('ch2o + h => hco + h2', [9.334000e+08, 1.5, 2976.1]) + +# Reaction 66 +reaction('hco + h2 => ch2o + h', [7.453000e+07, 1.5, 17650.1]) + +# Reaction 67 +reaction('ch2o + o => hco + oh', [4.160000e+11, 0.57, 2761.95]) + +# Reaction 68 +reaction('hco + oh => ch2o + o', [1.459000e+10, 0.57, 15340.11]) + +# Reaction 69 +reaction('ch3 + oh => ch2o + h2', [2.250000e+13, 0.0, 4299.95]) + +# Reaction 70 +reaction('ch2o + h2 => ch3 + oh', [6.756000e+14, 0.0, 76030.11]) + +# Reaction 71 +reaction('ch3 + o => ch2o + h', [8.000000e+13, 0.0, 0.0]) + +# Reaction 72 +reaction('ch2o + h => ch3 + o', [1.055000e+15, 0.0, 69630.02]) + +# Reaction 73 +reaction('ch3 + o2 => ch3o + o', [1.995000e+18, -1.57, 29210.09]) + +# Reaction 74 +reaction('ch3o + o => ch3 + o2', [3.585000e+18, -1.59, -1630.98]) + +# Reaction 75 +reaction('ch2o + ch3 => hco + ch4', [3.636000e-06, 5.42, 998.09]) + +# Reaction 76 +reaction('hco + ch4 => ch2o + ch3', [7.584000e-06, 5.42, 16150.1]) + +# Reaction 77 +reaction('hco + ch3 => ch4 + co', [1.210000e+14, 0.0, 0.0]) + +# Reaction 78 +reaction('ch4 + co => hco + ch3', [2.073000e+16, 0.0, 90479.92]) + +# Reaction 79 +falloff_reaction('ch3o (+ M) => ch2o + h (+ M)', + kf=[5.450000e+13, 0.0, 13500.0], + kf0=[2.344000e+25, -2.7, 30599.9]) + +# Reaction 80 +three_body_reaction('ch2o + h + M => ch3o + M', [3.812000e+09, 1.02, -7489.01]) + +# Reaction 81 +falloff_reaction('c2h4 (+ M) => c2h2 + h2 (+ M)', + kf=[1.800000e+13, 0.0, 76000.0], + kf0=[1.500000e+15, 0.0, 55443.12]) + +# Reaction 82 +three_body_reaction('c2h2 + h2 + M => c2h4 + M', [1.877000e+11, 0.17, 34780.11]) + +# Reaction 83 +reaction('ho2 + o => oh + o2', [3.250000e+13, 0.0, 0.0]) + +# Reaction 84 +reaction('oh + o2 => ho2 + o', [7.857000e+14, -0.33, 55390.06]) + +# Reaction 85 +reaction('hco + ho2 => ch2o + o2', [2.974000e+10, 0.33, -3860.9]) + +# Reaction 86 +reaction('ch2o + o2 => hco + ho2', [2.050000e+13, 0.0, 38950.05]) + +# Reaction 87 +reaction('ch3o + o2 => ch2o + ho2', [5.500000e+10, 0.0, 2424.0]) + +# Reaction 88 +reaction('ch2o + ho2 => ch3o + o2', [1.318000e+09, 0.35, 31390.06]) + +# Reaction 89 +reaction('ch3 + ho2 => ch4 + o2', [3.600000e+12, 0.0, 0.0]) + +# Reaction 90 +reaction('ch4 + o2 => ch3 + ho2', [5.177000e+15, -0.33, 57960.09]) + +# Reaction 91 +reaction('hco + o2 => co + ho2', [7.580000e+12, 0.0, 409.89]) + +# Reaction 92 +reaction('co + ho2 => hco + o2', [9.029000e+11, 0.33, 32929.97]) + +# Reaction 93 +reaction('ho2 + h => 2 oh', [7.080000e+13, 0.0, 299.95]) + +# Reaction 94 +reaction('2 oh => ho2 + h', [1.352000e+14, -0.33, 39570.03]) + +# Reaction 95 +reaction('ho2 + h => h2 + o2', [1.660000e+13, 0.0, 820.03]) + +# Reaction 96 +reaction('h2 + o2 => ho2 + h', [9.138000e+14, -0.33, 58299.95]) + +# Reaction 97 +reaction('ho2 + oh => h2o + o2', [2.890000e+13, 0.0, -500.0]) + +# Reaction 98 +reaction('h2o + o2 => ho2 + oh', [6.888000e+15, -0.33, 72140.06]) + +# Reaction 99 +reaction('h2o2 + o2 => 2 ho2', [5.942000e+17, -0.66, 53150.1], + options='duplicate') + +# Reaction 100 +reaction('2 ho2 => h2o2 + o2', [4.200000e+14, 0.0, 11979.92], + options='duplicate') + +# Reaction 101 +falloff_reaction('2 oh (+ M) => h2o2 (+ M)', + kf=[1.236000e+14, -0.37, 0.0], + kf0=[3.041000e+30, -4.63, 2049.0], + efficiencies='h2:2.5 h2o:12.0 co2:3.8 co:1.9', + falloff=Troe(A=0.47, T3=100.0, T1=2000.0, T2=1e+15)) + +# Reaction 102 +falloff_reaction('h2o2 (+ M) => 2 oh (+ M)', + kf=[3.138000e+19, -1.37, 51859.94], + kf0=[7.721000e+35, -5.63, 53908.94], + efficiencies='h2:2.5 h2o:12.0 co2:3.8 co:1.9', + falloff=Troe(A=0.47, T3=100.0, T1=2000.0, T2=1e+15)) + +# Reaction 103 +reaction('h2o2 + h => h2o + oh', [2.410000e+13, 0.0, 3969.89]) + +# Reaction 104 +reaction('h2o + oh => h2o2 + h', [7.750000e+12, 0.0, 74710.09]) + +# Reaction 105 +reaction('ch4 + ho2 => ch3 + h2o2', [3.420000e+11, 0.0, 19289.91]) + +# Reaction 106 +reaction('ch3 + h2o2 => ch4 + ho2', [3.365000e+11, -0.33, 2501.91]) + +# Reaction 107 +reaction('ch2o + ho2 => hco + h2o2', [5.820000e-03, 4.53, 6556.88]) + +# Reaction 108 +reaction('hco + h2o2 => ch2o + ho2', [1.194000e-02, 4.2, 4920.89]) + +# Reaction 109 +three_body_reaction('oh + M => o + h + M', [3.909000e+22, -2.0, 105299.95], + efficiencies='h2:2.5 h2o:12.0 co2:3.8 co:1.9') + +# Reaction 110 +three_body_reaction('o + h + M => oh + M', [4.720000e+18, -1.0, 0.0], + efficiencies='h2:2.5 h2o:12.0 co2:3.8 co:1.9') + +# Reaction 111 +three_body_reaction('o2 + M => 2 o + M', [6.473000e+20, -1.5, 121500.0], + efficiencies='h2:2.5 h2o:12.0 co2:3.8 co:1.9') + +# Reaction 112 +three_body_reaction('2 o + M => o2 + M', [6.170000e+15, -0.5, 0.0], + efficiencies='h2:2.5 h2o:12.0 co2:3.8 co:1.9') + +# Reaction 113 +three_body_reaction('h2 + M => 2 h + M', [4.570000e+19, -1.4, 104400.1], + efficiencies='h2:2.5 h2o:12.0 co2:3.8 co:1.9') + +# Reaction 114 +three_body_reaction('2 h + M => h2 + M', [2.423000e+15, -0.4, -3039.91], + efficiencies='h2:2.5 h2o:12.0 co2:3.8 co:1.9') + +# Reaction 115 +falloff_reaction('c2h3 + h (+ M) => c2h4 (+ M)', + kf=[6.100000e+12, 0.27, 280.11], + kf0=[9.800000e+29, -3.86, 3320.03], + falloff=Troe(A=0.782, T3=208.0, T1=2663.0, T2=6095.0)) + +# Reaction 116 +falloff_reaction('c2h4 (+ M) => c2h3 + h (+ M)', + kf=[1.692000e+15, 0.1, 107099.9], + kf0=[2.718000e+32, -4.03, 110139.82], + falloff=Troe(A=0.782, T3=208.0, T1=2663.0, T2=6095.0)) + +# Reaction 117 +reaction('c2h5 + c2h3 => 2 c2h4', [3.000000e+12, 0.0, 0.0]) + +# Reaction 118 +reaction('2 c2h4 => c2h5 + c2h3', [4.820000e+14, 0.0, 71530.11]) + +# Reaction 119 +falloff_reaction('c2h2 + h (+ M) => c2h3 (+ M)', + kf=[3.110000e+11, 0.58, 2588.91], + kf0=[2.254000e+40, -7.269, 6576.96], + efficiencies='h2:2.0 h2o:5.0 co2:3.0 co:2.0', + falloff=Troe(A=1.0, T3=1e-15, T1=675.0, T2=1e+15)) + +# Reaction 120 +falloff_reaction('c2h3 (+ M) => c2h2 + h (+ M)', + kf=[2.028000e+15, -0.42, 44460.09], + kf0=[1.470000e+44, -8.269, 48448.14], + efficiencies='h2:2.0 h2o:5.0 co2:3.0 co:2.0', + falloff=Troe(A=1.0, T3=1e-15, T1=675.0, T2=1e+15)) + +# Reaction 121 +reaction('c2h4 + h => c2h3 + h2', [8.420000e-03, 4.62, 2582.93]) + +# Reaction 122 +reaction('c2h3 + h2 => c2h4 + h', [5.723000e-01, 3.79, 3233.03]) + +# Reaction 123 +reaction('c2h4 + oh => c2h3 + h2o', [2.020000e+13, 0.0, 5955.07]) + +# Reaction 124 +reaction('c2h3 + h2o => c2h4 + oh', [1.015000e+13, 0.0, 20219.89]) + +# Reaction 125 +reaction('c2h3 + o2 => c2h2 + ho2', [5.190000e-15, -1.26, 3309.99], + options='duplicate') + +# Reaction 126 +reaction('c2h2 + ho2 => c2h3 + o2', [2.727000e-16, -0.93, 11400.1], + options='duplicate') + +# Reaction 127 +three_body_reaction('c2h2 + M => c2h + h + M', [4.200000e+16, 0.0, 107000.0]) + +# Reaction 128 +three_body_reaction('c2h + h + M => c2h2 + M', [7.130000e+07, 2.08, -28909.89]) + +# Reaction 129 +reaction('c2h2 + o2 => hcco + oh', [2.000000e+08, 1.5, 30099.9]) + +# Reaction 130 +reaction('hcco + oh => c2h2 + o2', [2.232000e+05, 1.5, 25400.1]) + +# Reaction 131 +reaction('ch2 + o2 => co + h2o', [7.280000e+19, -2.54, 1809.03]) + +# Reaction 132 +reaction('co + h2o => ch2 + o2', [8.508000e+20, -2.54, 179799.95]) + +# Reaction 133 +reaction('c2h2 + oh => c2h + h2o', [3.370000e+07, 2.0, 14000.0]) + +# Reaction 134 +reaction('c2h + h2o => c2h2 + oh', [4.671000e+03, 3.08, 684.99]) + +# Reaction 135 +reaction('o + c2h2 => c2h + oh', [3.160000e+15, -0.6, 15000.0]) + +# Reaction 136 +reaction('c2h + oh => o + c2h2', [4.443000e+10, 0.48, -15570.03]) + +# Reaction 137 +reaction('c2h2 + o => ch2 + co', [6.120000e+06, 2.0, 1900.1]) + +# Reaction 138 +reaction('ch2 + co => c2h2 + o', [1.152000e+06, 2.0, 52570.03]) + +# Reaction 139 +reaction('c2h + o2 => hco + co', [2.410000e+12, 0.0, 0.0]) + +# Reaction 140 +reaction('hco + co => c2h + o2', [1.328000e+16, -1.08, 154099.9]) + +# Reaction 141 +reaction('c2h + o => co + ch', [1.810000e+13, 0.0, 0.0]) + +# Reaction 142 +reaction('co + ch => c2h + o', [7.478000e+16, -1.08, 82130.02]) + +# Reaction 143 +reaction('ch2 + o2 => hco + oh', [1.290000e+20, -3.3, 283.94]) + +# Reaction 144 +reaction('hco + oh => ch2 + o2', [5.310000e+19, -3.3, 73169.93]) + +# Reaction 145 +reaction('ch2 + o => co + 2 h', [5.000000e+13, 0.0, 0.0]) + +# Reaction 146 +reaction('co + 2 h => ch2 + o', [0.000000e+00, 0.0, 0.0]) + +# Reaction 147 +reaction('ch2 + h => ch + h2', [1.000000e+18, -1.56, 0.0]) + +# Reaction 148 +reaction('ch + h2 => ch2 + h', [7.026000e+17, -1.56, 2989.96]) + +# Reaction 149 +reaction('ch2 + oh => ch + h2o', [1.130000e+07, 2.0, 3000.0]) + +# Reaction 150 +reaction('ch + h2o => ch2 + oh', [3.437000e+07, 2.0, 21150.1]) + +# Reaction 151 +reaction('ch2 + o2 => co2 + 2 h', [3.290000e+21, -3.3, 2868.07]) + +# Reaction 152 +reaction('co2 + 2 h => ch2 + o2', [0.000000e+00, 0.0, 0.0]) + +# Reaction 153 +reaction('ch + o2 => hco + o', [3.300000e+13, 0.0, 0.0]) + +# Reaction 154 +reaction('hco + o => ch + o2', [4.402000e+13, 0.0, 71989.96]) + +# Reaction 155 +reaction('ch3oh + oh => ch2oh + h2o', [7.100000e+06, 1.8, -596.08]) + +# Reaction 156 +reaction('ch2oh + h2o => ch3oh + oh', [3.293000e+01, 3.46, 22719.89]) + +# Reaction 157 +reaction('ch3oh + h => ch3o + h2', [3.600000e+12, 0.0, 6094.89]) + +# Reaction 158 +reaction('ch3o + h2 => ch3oh + h', [7.467000e+12, -0.02, 7825.05]) + +# Reaction 159 +reaction('ch3oh + h => ch2oh + h2', [1.440000e+13, 0.0, 6094.89]) + +# Reaction 160 +reaction('ch2oh + h2 => ch3oh + h', [1.543000e+07, 1.66, 14250.0]) + +# Reaction 161 +reaction('ch3oh + ch3 => ch2oh + ch4', [3.190000e+01, 3.17, 7172.08]) + +# Reaction 162 +reaction('ch2oh + ch4 => ch3oh + ch3', [8.927000e-04, 4.83, 15809.99]) + +# Reaction 163 +reaction('ch3oh + o => ch2oh + oh', [3.880000e+05, 2.5, 3080.07]) + +# Reaction 164 +reaction('ch2oh + oh => ch3oh + o', [4.960000e+03, 2.5, 8781.07]) + +# Reaction 165 +reaction('ch2oh + o2 => ch2o + ho2', [3.810000e+06, 2.0, 1641.01]) + +# Reaction 166 +reaction('ch2o + ho2 => ch2oh + o2', [1.768000e+11, 0.67, 24179.97]) + +# Reaction 167 +falloff_reaction('ch2oh (+ M) => ch2o + h (+ M)', + kf=[2.800000e+14, -0.73, 32820.03], + kf0=[6.010000e+33, -5.39, 36200.05], + falloff=Troe(A=0.96, T3=67.6, T1=1855.0, T2=7543.0)) + +# Reaction 168 +falloff_reaction('ch2o + h (+ M) => ch2oh (+ M)', + kf=[3.792000e+16, -1.39, 5402.01], + kf0=[8.139000e+35, -6.05, 8782.03], + falloff=Troe(A=0.96, T3=67.6, T1=1855.0, T2=7543.0)) + +# Reaction 169 +reaction('c2h3 + o2 => c2h2 + ho2', [2.120000e-06, 6.0, 9483.99], + options='duplicate') + +# Reaction 170 +reaction('c2h2 + ho2 => c2h3 + o2', [1.114000e-07, 6.33, 17570.03], + options='duplicate') + +# Reaction 171 +reaction('h2o2 + o => oh + ho2', [9.550000e+06, 2.0, 3969.89]) + +# Reaction 172 +reaction('oh + ho2 => h2o2 + o', [2.541000e+07, 1.68, 19849.9]) + +# Reaction 173 +reaction('c2h2 + o => hcco + h', [1.430000e+07, 2.0, 1900.1]) + +# Reaction 174 +reaction('hcco + h => c2h2 + o', [2.021000e+05, 2.0, 13309.99]) + +# Reaction 175 +reaction('c2h2 + oh => ch2co + h', [2.190000e-04, 4.5, -1000.0]) + +# Reaction 176 +reaction('ch2co + h => c2h2 + oh', [2.161000e-03, 4.5, 19669.93]) + +# Reaction 177 +reaction('ch2co + h => ch3 + co', [1.100000e+13, 0.0, 3400.1]) + +# Reaction 178 +reaction('ch3 + co => ch2co + h', [2.400000e+12, 0.0, 40200.05]) + +# Reaction 179 +reaction('ch2co + o => ch2 + co2', [1.750000e+12, 0.0, 1349.9]) + +# Reaction 180 +reaction('ch2 + co2 => ch2co + o', [3.739000e+12, 0.0, 53690.01]) + +# Reaction 181 +reaction('ch2 + o2 => ch2o + o', [3.290000e+21, -3.3, 2868.07]) + +# Reaction 182 +reaction('ch2o + o => ch2 + o2', [3.862000e+22, -3.3, 63179.97]) + +# Reaction 183 +falloff_reaction('ch2co (+ M) => ch2 + co (+ M)', + kf=[3.000000e+14, 0.0, 70979.92], + kf0=[3.600000e+15, 0.0, 59270.08]) + +# Reaction 184 +three_body_reaction('ch2 + co + M => ch2co + M', [6.909000e+08, 1.0, -4359.94]) + +# Reaction 185 +reaction('ch2co + o => hcco + oh', [1.000000e+13, 0.0, 8000.0]) + +# Reaction 186 +reaction('hcco + oh => ch2co + o', [1.432000e+10, 0.0, -1255.02]) + +# Reaction 187 +reaction('ch2co + oh => hcco + h2o', [1.000000e+13, 0.0, 2000.0]) + +# Reaction 188 +reaction('hcco + h2o => ch2co + oh', [1.412000e+11, 0.0, 9994.98]) + +# Reaction 189 +reaction('ch2co + h => hcco + h2', [2.000000e+14, 0.0, 8000.0]) + +# Reaction 190 +reaction('hcco + h2 => ch2co + h', [6.522000e+11, 0.0, 840.11]) + +# Reaction 191 +reaction('hcco + oh => 2 hco', [1.000000e+13, 0.0, 0.0]) + +# Reaction 192 +reaction('2 hco => hcco + oh', [4.820000e+13, 0.0, 40359.94]) + +# Reaction 193 +reaction('hcco + h => ch2(s) + co', [1.100000e+14, 0.0, 0.0]) + +# Reaction 194 +reaction('ch2(s) + co => hcco + h', [6.660000e+13, 0.0, 39260.04]) + +# Reaction 195 +reaction('hcco + o => h + 2 co', [8.000000e+13, 0.0, 0.0]) + +# Reaction 196 +reaction('h + 2 co => hcco + o', [0.000000e+00, 0.0, 0.0]) + +# Reaction 197 +reaction('c2h6 + o2 => c2h5 + ho2', [4.000000e+13, 0.0, 50900.1]) + +# Reaction 198 +reaction('c2h5 + ho2 => c2h6 + o2', [3.000000e+11, 0.0, 0.0]) + +# Reaction 199 +reaction('c2h6 + ho2 => c2h5 + h2o2', [1.700000e+13, 0.0, 20460.09]) + +# Reaction 200 +reaction('c2h5 + h2o2 => c2h6 + ho2', [1.069000e+11, 0.24, 7842.02]) + +# Reaction 201 +reaction('ch2 + o2 => co2 + h2', [1.010000e+21, -3.3, 1507.89]) + +# Reaction 202 +reaction('co2 + h2 => ch2 + o2', [3.054000e+23, -3.3, 186700.05]) + +# Reaction 203 +reaction('ch3 + c2h3 => ch4 + c2h2', [3.920000e+11, 0.0, 0.0]) + +# Reaction 204 +reaction('ch4 + c2h2 => ch3 + c2h3', [2.962000e+13, 0.0, 66049.95]) + +# Reaction 205 +reaction('ch3 + c2h5 => ch4 + c2h4', [1.950000e+13, -0.5, 0.0]) + +# Reaction 206 +reaction('ch4 + c2h4 => ch3 + c2h5', [2.895000e+16, -0.7, 70169.93]) + +# Reaction 207 +reaction('ch3oh + ch2o => 2 ch3o', [3.835000e+13, 0.05, 84719.89]) + +# Reaction 208 +reaction('2 ch3o => ch3oh + ch2o', [6.030000e+13, 0.0, 0.0]) + +# Reaction 209 +reaction('ch2o + ch3o => ch3oh + hco', [1.150000e+11, 0.0, 1280.11]) + +# Reaction 210 +reaction('ch3oh + hco => ch2o + ch3o', [3.020000e+11, 0.0, 18159.89]) + +# Reaction 211 +reaction('ch4 + ch3o => ch3 + ch3oh', [1.570000e+11, 0.0, 8842.02]) + +# Reaction 212 +reaction('ch3 + ch3oh => ch4 + ch3o', [1.046000e+09, 0.0, 50000.0]) + +# Reaction 213 +reaction('c2h6 + ch3o => c2h5 + ch3oh', [3.000000e+11, 0.0, 7000.0]) + +# Reaction 214 +reaction('c2h5 + ch3oh => c2h6 + ch3o', [1.714000e+10, 0.0, 50000.0]) + +# Reaction 215 +reaction('c2h3 + h => c2h2 + h2', [2.000000e+13, 0.0, 2500.0]) + +# Reaction 216 +reaction('c2h2 + h2 => c2h3 + h', [1.331000e+13, 0.0, 68080.07]) + +# Reaction 217 +reaction('ch3o + ch3oh => ch2oh + ch3oh', [3.000000e+11, 0.0, 4074.09]) + +# Reaction 218 +reaction('ch2oh + ch3oh => ch3o + ch3oh', [1.549000e+05, 1.68, 10500.0]) + +# Reaction 219 +reaction('ch3oh + oh => ch3o + h2o', [1.000000e+06, 2.1, 496.65]) + +# Reaction 220 +reaction('ch3o + h2o => ch3oh + oh', [8.981000e+06, 2.08, 17380.02]) + +# Reaction 221 +reaction('c2h5 + h => 2 ch3', [3.610000e+13, 0.0, 0.0]) + +# Reaction 222 +reaction('2 ch3 => c2h5 + h', [5.446000e+16, -1.03, 16979.92]) + +# Reaction 223 +reaction('c2h3 + o2 => ch2o + hco', [1.700000e+29, -5.31, 6500.0]) + +# Reaction 224 +reaction('ch2o + hco => c2h3 + o2', [1.657000e+29, -5.31, 93049.95]) + +# Reaction 225 +reaction('c2h6 => c2h5 + h', [2.783000e+21, -1.56, 103799.95]) + +# Reaction 226 +reaction('c2h5 + h => c2h6', [3.610000e+13, 0.0, 0.0]) + +# Reaction 227 +reaction('pc2h4oh => c2h4 + oh', [1.293000e+12, -0.37, 26849.9]) + +# Reaction 228 +reaction('c2h4 + oh => pc2h4oh', [9.930000e+11, 0.0, -960.09]) + +# Reaction 229 +reaction('c2h4 + ch3 => c2h3 + ch4', [6.620000e+00, 3.7, 9500.0]) + +# Reaction 230 +reaction('c2h3 + ch4 => c2h4 + ch3', [1.440000e+00, 4.02, 5472.04]) + +# Reaction 231 +falloff_reaction('ch3co (+ M) => ch3 + co (+ M)', + kf=[3.000000e+12, 0.0, 16719.89], + kf0=[1.200000e+15, 0.0, 12517.93]) + +# Reaction 232 +three_body_reaction('ch3 + co + M => ch3co + M', [9.623000e+11, -0.13, 9777.96]) + +# Reaction 233 +reaction('ch3cho => ch3 + hco', [2.614000e+15, 0.15, 80549.95]) + +# Reaction 234 +reaction('ch3 + hco => ch3cho', [2.000000e+13, 0.0, 0.0]) + +# Reaction 235 +reaction('ch3cho + o2 => ch3co + ho2', [3.010000e+13, 0.0, 39150.1]) + +# Reaction 236 +reaction('ch3co + ho2 => ch3cho + o2', [8.552000e+10, 0.32, -1940.01]) + +# Reaction 237 +reaction('ch3cho + oh => ch3co + h2o', [2.000000e+06, 1.8, 1299.95]) + +# Reaction 238 +reaction('ch3co + h2o => ch3cho + oh', [1.354000e+06, 1.79, 32849.9]) + +# Reaction 239 +reaction('ch3cho + h => ch3co + h2', [1.340000e+13, 0.0, 3299.95]) + +# Reaction 240 +reaction('ch3co + h2 => ch3cho + h', [2.096000e+12, -0.01, 19690.01]) + +# Reaction 241 +reaction('ch3cho + o => ch3co + oh', [5.940000e+12, 0.0, 1868.07]) + +# Reaction 242 +reaction('ch3co + oh => ch3cho + o', [4.080000e+11, -0.01, 16169.93]) + +# Reaction 243 +reaction('ch3cho + ho2 => ch3co + h2o2', [3.010000e+12, 0.0, 11929.97]) + +# Reaction 244 +reaction('ch3co + h2o2 => ch3cho + ho2', [1.210000e+13, -0.34, 12010.04]) + +# Reaction 245 +reaction('ch3cho + ch3 => ch3co + ch4', [2.608000e+06, 1.78, 5911.09]) + +# Reaction 246 +reaction('ch3co + ch4 => ch3cho + ch3', [1.066000e+07, 1.77, 22789.91]) + +# Reaction 247 +reaction('c3h5-s => c2h2 + ch3', [9.598000e+39, -8.17, 42030.11]) + +# Reaction 248 +reaction('c2h2 + ch3 => c3h5-s', [1.610000e+40, -8.58, 20330.07]) + +# Reaction 249 +reaction('c2h2 + ch3 => c3h4-p + h', [1.211000e+17, -1.2, 16679.97]) + +# Reaction 250 +reaction('c3h4-p + h => c2h2 + ch3', [1.000000e+14, 0.0, 4000.0]) + +# Reaction 251 +reaction('c3h5-a => c2h2 + ch3', [2.397000e+48, -9.9, 82080.07]) + +# Reaction 252 +reaction('c2h2 + ch3 => c3h5-a', [2.610000e+46, -9.82, 36950.05]) + +# Reaction 253 +reaction('c3h6 => c2h3 + ch3', [2.730000e+62, -13.28, 123200.05]) + +# Reaction 254 +reaction('c2h3 + ch3 => c3h6', [4.712000e+59, -13.19, 29539.91]) + +# Reaction 255 +reaction('c2h2 + ch3 => c3h4-a + h', [6.740000e+19, -2.08, 31590.11]) + +# Reaction 256 +reaction('c3h4-a + h => c2h2 + ch3', [1.149000e+16, -0.7, 15789.91]) + +# Reaction 257 +reaction('c3h6 => c3h5-a + h', [2.010000e+61, -13.26, 118500.0]) + +# Reaction 258 +reaction('c3h5-a + h => c3h6', [4.887000e+56, -12.25, 28080.07]) + +# Reaction 259 +reaction('c3h6 + o => ch2co + ch3 + h', [2.500000e+07, 1.76, 76.0]) + +# Reaction 260 +reaction('ch2co + ch3 + h => c3h6 + o', [0.000000e+00, 0.0, 0.0]) + +# Reaction 261 +reaction('c3h6 + o => c2h5 + hco', [1.580000e+07, 1.76, -1216.06]) + +# Reaction 262 +reaction('c2h5 + hco => c3h6 + o', [1.402000e+05, 1.88, 26510.04]) + +# Reaction 263 +reaction('c3h6 + o => ch3chco + 2 h', [2.500000e+07, 1.76, 76.0]) + +# Reaction 264 +reaction('ch3chco + 2 h => c3h6 + o', [0.000000e+00, 0.0, 0.0]) + +# Reaction 265 +reaction('c3h6 => c3h5-s + h', [7.710000e+69, -16.09, 140000.0]) + +# Reaction 266 +reaction('c3h5-s + h => c3h6', [1.217000e+63, -14.6, 26159.89]) + +# Reaction 267 +reaction('c3h6 + ho2 => c3h5-a + h2o2', [1.500000e+11, 0.0, 14190.01]) + +# Reaction 268 +reaction('c3h5-a + h2o2 => c3h6 + ho2', [5.867000e+05, 1.33, 9759.08]) + +# Reaction 269 +reaction('c3h6 + ho2 => c3h5-s + h2o2', [7.500000e+09, 0.0, 12570.03]) + +# Reaction 270 +reaction('c3h5-s + h2o2 => c3h6 + ho2', [2.308000e+04, 1.27, -13419.93]) + +# Reaction 271 +reaction('c3h6 + ho2 => c3h5-t + h2o2', [3.000000e+09, 0.0, 9929.97]) + +# Reaction 272 +reaction('c3h5-t + h2o2 => c3h6 + ho2', [9.234000e+03, 1.27, -14059.99]) + +# Reaction 273 +reaction('c3h6 + oh => c3h5-a + h2o', [3.120000e+06, 2.0, -298.04]) + +# Reaction 274 +reaction('c3h5-a + h2o => c3h6 + oh', [6.194000e+06, 2.01, 31880.02]) + +# Reaction 275 +reaction('c3h6 + oh => c3h5-s + h2o', [2.110000e+06, 2.0, 2777.96]) + +# Reaction 276 +reaction('c3h5-s + h2o => c3h6 + oh', [2.719000e+04, 2.49, 11530.11]) + +# Reaction 277 +reaction('c4h6 => 2 c2h3', [4.027000e+19, -1.0, 98150.1]) + +# Reaction 278 +reaction('2 c2h3 => c4h6', [1.260000e+13, 0.0, 0.0]) + +# Reaction 279 +reaction('c4h6 + oh => c2h5 + ch2co', [1.000000e+12, 0.0, 0.0]) + +# Reaction 280 +reaction('c2h5 + ch2co => c4h6 + oh', [3.730000e+12, 0.0, 30020.08]) + +# Reaction 281 +reaction('c4h6 + oh => ch2o + c3h5-a', [1.000000e+12, 0.0, 0.0]) + +# Reaction 282 +reaction('ch2o + c3h5-a => c4h6 + oh', [3.501000e+06, 0.0, 71059.99]) + +# Reaction 283 +reaction('c4h6 + oh => c2h3 + ch3cho', [1.000000e+12, 0.0, 0.0]) + +# Reaction 284 +reaction('c2h3 + ch3cho => c4h6 + oh', [5.437000e+11, 0.0, 18549.95]) + +# Reaction 285 +reaction('c4h6 + o => c2h4 + ch2co', [1.000000e+12, 0.0, 0.0]) + +# Reaction 286 +reaction('c2h4 + ch2co => c4h6 + o', [6.377000e+11, 0.0, 94340.11]) + +# Reaction 287 +reaction('c4h6 + o => ch2o + c3h4-a', [1.000000e+12, 0.0, 0.0]) + +# Reaction 288 +reaction('ch2o + c3h4-a => c4h6 + o', [1.075000e+12, 0.0, 79049.95]) + +# Reaction 289 +reaction('c2h4 + o2 => c2h3 + ho2', [4.000000e+13, 0.0, 58200.05]) + +# Reaction 290 +reaction('c2h3 + ho2 => c2h4 + o2', [4.939000e+13, -0.5, 1368.07]) + +# Reaction 291 +three_body_reaction('ch2o + M => co + h2 + M', [1.826000e+32, -4.42, 87119.98]) + +# Reaction 292 +three_body_reaction('co + h2 + M => ch2o + M', [5.070000e+27, -3.42, 84349.9]) + +# Reaction 293 +reaction('nc3h7 => ch3 + c2h4', [2.284000e+14, -0.55, 28400.1]) + +# Reaction 294 +reaction('ch3 + c2h4 => nc3h7', [4.100000e+11, 0.0, 7204.11]) + +# Reaction 295 +reaction('nc3h7 => h + c3h6', [2.667000e+15, -0.64, 36820.03]) + +# Reaction 296 +reaction('h + c3h6 => nc3h7', [1.000000e+13, 0.0, 2500.0]) + +# Reaction 297 +reaction('nc3h7 + o2 => c3h6 + ho2', [3.000000e+11, 0.0, 3000.0]) + +# Reaction 298 +reaction('c3h6 + ho2 => nc3h7 + o2', [2.000000e+11, 0.0, 17500.0]) + +# Reaction 299 +reaction('c2h4 + ch3o => c2h3 + ch3oh', [1.200000e+11, 0.0, 6750.0]) + +# Reaction 300 +reaction('c2h3 + ch3oh => c2h4 + ch3o', [1.000000e+10, 0.0, 9000.0]) + +# Reaction 301 +reaction('c3h6 + oh => c3h5-t + h2o', [1.110000e+06, 2.0, 1451.0]) + +# Reaction 302 +reaction('c3h5-t + h2o => c3h6 + oh', [3.276000e+03, 2.69, 12309.99]) + +# Reaction 303 +reaction('c3h6 + o => c3h5-a + oh', [5.240000e+11, 0.7, 5884.08]) + +# Reaction 304 +reaction('c3h5-a + oh => c3h6 + o', [1.055000e+11, 0.71, 20820.03]) + +# Reaction 305 +reaction('c3h6 + o => c3h5-s + oh', [1.200000e+11, 0.7, 8958.89]) + +# Reaction 306 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+# Reaction 318 +reaction('c3h6 + h2 => ic3h7 + h', [4.822000e+09, 0.69, 12090.11]) + +# Reaction 319 +reaction('ic3h7 + o2 => c3h6 + ho2', [4.500000e+11, 0.0, 5020.08]) + +# Reaction 320 +reaction('c3h6 + ho2 => ic3h7 + o2', [2.000000e+11, 0.0, 17500.0]) + +# Reaction 321 +reaction('c3h8 => ch3 + c2h5', [7.900000e+22, -1.8, 88630.02]) + +# Reaction 322 +reaction('ch3 + c2h5 => c3h8', [3.659000e+14, -0.36, 989.01]) + +# Reaction 323 +reaction('c3h8 + o2 => ic3h7 + ho2', [4.000000e+13, 0.0, 47500.0]) + +# Reaction 324 +reaction('ic3h7 + ho2 => c3h8 + o2', [2.080000e+12, 0.0, 0.0]) + +# Reaction 325 +reaction('c3h8 + o2 => nc3h7 + ho2', [4.000000e+13, 0.0, 47500.0]) + +# Reaction 326 +reaction('nc3h7 + ho2 => c3h8 + o2', [2.080000e+12, 0.0, 0.0]) + +# Reaction 327 +reaction('h + c3h8 => h2 + ic3h7', [1.300000e+06, 2.4, 4471.08]) + +# Reaction 328 +reaction('h2 + ic3h7 => h + c3h8', [4.709000e+05, 2.15, 12179.97]) + +# Reaction 329 +reaction('h + c3h8 => h2 + nc3h7', [1.880000e+05, 2.75, 6280.11]) + +# Reaction 330 +reaction('h2 + nc3h7 => h + c3h8', [2.756000e+01, 3.44, 9530.11]) + +# Reaction 331 +reaction('c3h8 + o => ic3h7 + oh', [2.810000e+13, 0.0, 5200.05]) + +# Reaction 332 +reaction('ic3h7 + oh => c3h8 + o', [1.870000e+12, 0.0, 9607.07]) + +# Reaction 333 +reaction('c3h8 + o => nc3h7 + oh', [1.130000e+14, 0.0, 7849.9]) + +# Reaction 334 +reaction('nc3h7 + oh => c3h8 + o', [7.530000e+12, 0.0, 12260.04]) + +# Reaction 335 +reaction('c3h8 + oh => nc3h7 + h2o', [1.054000e+10, 0.97, 1586.04]) + +# Reaction 336 +reaction('nc3h7 + h2o => c3h8 + oh', [6.931000e+09, 0.97, 23250.0]) + +# Reaction 337 +reaction('c3h8 + oh => ic3h7 + h2o', [4.670000e+07, 1.61, -34.89]) + +# Reaction 338 +reaction('ic3h7 + h2o => c3h8 + oh', [3.071000e+07, 1.61, 21630.02]) + +# Reaction 339 +reaction('c3h8 + ho2 => ic3h7 + h2o2', [5.600000e+12, 0.0, 17700.05]) + +# Reaction 340 +reaction('ic3h7 + h2o2 => c3h8 + ho2', [4.160000e+11, 0.0, 7425.91]) + +# Reaction 341 +reaction('c3h8 + ho2 => nc3h7 + h2o2', [1.680000e+13, 0.0, 20429.97]) + +# Reaction 342 +reaction('nc3h7 + h2o2 => c3h8 + ho2', [2.330000e+12, 0.0, 9826.0]) + +# Reaction 343 +reaction('ch3 + c3h8 => ch4 + ic3h7', [3.980000e+11, 0.0, 9500.0]) + +# Reaction 344 +reaction('ch4 + ic3h7 => ch3 + c3h8', [1.585000e+12, 0.0, 16479.92]) + +# Reaction 345 +reaction('ch3 + c3h8 => ch4 + nc3h7', [1.290000e+12, 0.0, 11599.9]) + +# Reaction 346 +reaction('ch4 + nc3h7 => ch3 + c3h8', [5.129000e+12, 0.0, 18580.07]) + +# Reaction 347 +reaction('ic3h7 + c3h8 => nc3h7 + c3h8', [3.000000e+10, 0.0, 12900.1]) + +# Reaction 348 +reaction('nc3h7 + c3h8 => ic3h7 + c3h8', [3.000000e+10, 0.0, 12900.1]) + +# Reaction 349 +reaction('c2h3 + c3h8 => c2h4 + ic3h7', [1.000000e+11, 0.0, 10400.1]) + +# Reaction 350 +reaction('c2h4 + ic3h7 => c2h3 + c3h8', [1.310000e+11, 0.0, 17799.95]) + +# Reaction 351 +reaction('c2h3 + c3h8 => c2h4 + nc3h7', [1.000000e+11, 0.0, 10400.1]) + +# Reaction 352 +reaction('c2h4 + nc3h7 => c2h3 + c3h8', [1.310000e+11, 0.0, 17799.95]) + +# Reaction 353 +reaction('c2h5 + c3h8 => c2h6 + ic3h7', [1.000000e+11, 0.0, 10400.1]) + +# Reaction 354 +reaction('c2h6 + ic3h7 => c2h5 + c3h8', [3.630000e+10, 0.0, 9934.03]) + +# Reaction 355 +reaction('c2h5 + c3h8 => c2h6 + nc3h7', [1.000000e+11, 0.0, 10400.1]) + +# Reaction 356 +reaction('c2h6 + nc3h7 => c2h5 + c3h8', [3.630000e+10, 0.0, 9934.03]) + +# Reaction 357 +reaction('c3h8 + c3h5-a => ic3h7 + c3h6', [2.000000e+11, 0.0, 16099.9]) + +# Reaction 358 +reaction('ic3h7 + c3h6 => c3h8 + c3h5-a', [3.980000e+10, 0.0, 9700.05]) + +# Reaction 359 +reaction('c3h8 + c3h5-a => nc3h7 + c3h6', [7.940000e+11, 0.0, 20500.0]) + +# Reaction 360 +reaction('nc3h7 + c3h6 => c3h8 + c3h5-a', [1.000000e+11, 0.0, 9799.95]) + +# Reaction 361 +reaction('c3h8 + ch3o => nc3h7 + ch3oh', [3.000000e+11, 0.0, 7000.0]) + +# Reaction 362 +reaction('nc3h7 + ch3oh => c3h8 + ch3o', [1.220000e+10, 0.0, 9181.88]) + +# Reaction 363 +reaction('c3h8 + ch3o => ic3h7 + ch3oh', [3.000000e+11, 0.0, 7000.0]) + +# Reaction 364 +reaction('ic3h7 + ch3oh => c3h8 + ch3o', [1.220000e+10, 0.0, 9181.88]) + +# Reaction 365 +reaction('c5h9 => c3h5-a + c2h4', [2.500000e+13, 0.0, 45000.0]) + +# Reaction 366 +reaction('c3h5-a + c2h4 => c5h9', [0.000000e+00, 0.0, 0.0]) + +# Reaction 367 +reaction('c5h9 => c2h3 + c3h6', [2.500000e+13, 0.0, 30000.0]) + +# Reaction 368 +reaction('c2h3 + c3h6 => c5h9', [1.500000e+10, 0.0, 7400.1]) + +# Reaction 369 +reaction('c4h7 => c4h6 + h', [1.200000e+14, 0.0, 49299.95]) + +# Reaction 370 +reaction('c4h6 + h => c4h7', [4.000000e+13, 0.0, 1299.95]) + +# Reaction 371 +reaction('c4h7 => c2h4 + c2h3', [1.000000e+11, 0.0, 37000.0]) + +# Reaction 372 +reaction('c2h4 + c2h3 => c4h7', [5.000000e+10, 0.0, 7000.0]) + +# Reaction 373 +reaction('c4h8-1 + c4h6 => 2 c4h7', [2.350000e+12, 0.0, 46719.89]) + +# Reaction 374 +reaction('2 c4h7 => c4h8-1 + c4h6', [1.600000e+12, 0.0, 0.0]) + +# Reaction 375 +reaction('c4h7 + ch3 => c4h6 + ch4', [8.000000e+12, 0.0, 0.0]) + +# Reaction 376 +reaction('c4h6 + ch4 => c4h7 + ch3', [7.050000e+13, 0.0, 57280.11]) + +# Reaction 377 +reaction('c3h5-a + c4h7 => c3h6 + c4h6', [6.310000e+12, 0.0, 0.0]) + +# Reaction 378 +reaction('c3h6 + c4h6 => c3h5-a + c4h7', [1.000000e+10, 0.0, 50000.0]) + +# Reaction 379 +reaction('c4h7 + o2 => c4h6 + ho2', [1.000000e+09, 0.0, 0.0]) + +# Reaction 380 +reaction('c4h6 + ho2 => c4h7 + o2', [1.000000e+11, 0.0, 17000.0]) + +# Reaction 381 +reaction('h + c4h7 => c4h6 + h2', [3.160000e+13, 0.0, 0.0]) + +# Reaction 382 +reaction('c4h6 + h2 => h + c4h7', [1.066000e+13, 0.0, 56809.99]) + +# Reaction 383 +reaction('c2h5 + c4h7 => c4h6 + c2h6', [3.980000e+12, 0.0, 0.0]) + +# Reaction 384 +reaction('c4h6 + c2h6 => c2h5 + c4h7', [3.211000e+12, 0.0, 49840.11]) + +# Reaction 385 +reaction('c2h5 + c4h7 => c2h4 + c4h8-1', [9.240000e+06, 1.5, -962.0]) + +# Reaction 386 +reaction('c2h4 + c4h8-1 => c2h5 + c4h7', [7.807000e+02, 2.91, 50960.09]) + +# Reaction 387 +reaction('c2h3 + c4h7 => 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oh => c4h7 + h2o', [2.250000e+13, 0.0, 2217.02]) + +# Reaction 400 +reaction('c4h7 + h2o => c4h8-1 + oh', [4.772000e+12, 0.0, 26469.89]) + +# Reaction 401 +reaction('c4h8-1 + c3h5-a => c4h7 + c3h6', [7.900000e+10, 0.0, 12400.1]) + +# Reaction 402 +reaction('c4h7 + c3h6 => c4h8-1 + c3h5-a', [1.000000e+11, 0.0, 17500.0]) + +# Reaction 403 +reaction('c4h8-1 + ho2 => c4h7 + h2o2', [1.400000e+12, 0.0, 14900.1]) + +# Reaction 404 +reaction('c4h7 + h2o2 => c4h8-1 + ho2', [3.160000e+11, 0.0, 13000.0]) + +# Reaction 405 +reaction('c4h8-1 + o2 => c4h7 + ho2', [2.700000e+13, 0.0, 33200.05]) + +# Reaction 406 +reaction('c4h7 + ho2 => c4h8-1 + o2', [3.000000e+11, 0.0, 0.0]) + +# Reaction 407 +reaction('sc4h9 => c3h6 + ch3', [7.367000e+17, -1.4, 30229.92]) + +# Reaction 408 +reaction('c3h6 + ch3 => sc4h9', [3.300000e+11, 0.0, 7200.05]) + +# Reaction 409 +reaction('sc4h9 => c4h8-1 + h', [3.586000e+20, -2.1, 40969.89]) + +# Reaction 410 +reaction('c4h8-1 + h => sc4h9', [1.000000e+13, 0.0, 1200.05]) + 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ch3coch2 + ho2', [1.200000e+14, 0.0, 46000.0]) + +# Reaction 434 +reaction('ch3coch2 + ho2 => ch3coch3 + o2', [2.000000e+12, 0.0, 2000.0]) + +# Reaction 435 +reaction('ch3coch3 + ho2 => ch3coch2 + h2o2', [1.700000e+13, 0.0, 20460.09]) + +# Reaction 436 +reaction('ch3coch2 + h2o2 => ch3coch3 + ho2', [1.000000e+11, 0.0, 8000.0]) + +# Reaction 437 +reaction('c2h5co => c2h5 + co', [1.834000e+15, -0.73, 12909.89]) + +# Reaction 438 +reaction('c2h5 + co => c2h5co', [1.510000e+11, 0.0, 4809.99]) + +# Reaction 439 +reaction('c2h5cho + h => c2h5co + h2', [3.980000e+13, 0.0, 4200.05]) + +# Reaction 440 +reaction('c2h5co + h2 => c2h5cho + h', [1.778000e+13, 0.0, 23669.93]) + +# Reaction 441 +reaction('c2h5cho + o => c2h5co + oh', [5.010000e+12, 0.0, 1789.91]) + +# Reaction 442 +reaction('c2h5co + oh => c2h5cho + o', [1.000000e+12, 0.0, 19159.89]) + +# Reaction 443 +reaction('c2h5cho + oh => c2h5co + h2o', [2.690000e+10, 0.76, -340.11]) + +# Reaction 444 +reaction('c2h5co + h2o => c2h5cho + oh', [1.705000e+10, 0.76, 31200.05]) + +# Reaction 445 +reaction('c2h5cho + ch3 => c2h5co + ch4', [2.608000e+06, 1.78, 5911.09]) + +# Reaction 446 +reaction('c2h5co + ch4 => c2h5cho + ch3', [9.972000e+06, 1.78, 22780.11]) + +# Reaction 447 +reaction('c2h5cho + ho2 => c2h5co + h2o2', [1.000000e+12, 0.0, 11000.0]) + +# Reaction 448 +reaction('c2h5co + h2o2 => c2h5cho + ho2', [1.000000e+12, 0.0, 14000.0]) + +# Reaction 449 +reaction('c2h5cho + ch3o => c2h5co + ch3oh', [1.000000e+12, 0.0, 3299.95]) + +# Reaction 450 +reaction('c2h5co + ch3oh => c2h5cho + ch3o', [3.160000e+11, 0.0, 18000.0]) + +# Reaction 451 +reaction('c2h5cho + c2h5 => c2h5co + c2h6', [1.000000e+12, 0.0, 8000.0]) + +# Reaction 452 +reaction('c2h5co + c2h6 => c2h5cho + c2h5', [1.585000e+13, 0.0, 28000.0]) + +# Reaction 453 +reaction('c2h5cho => c2h5 + hco', [9.850000e+18, -0.73, 81710.09]) + +# Reaction 454 +reaction('c2h5 + hco => c2h5cho', [1.810000e+13, 0.0, 0.0]) + +# Reaction 455 +reaction('c2h5cho + o2 => c2h5co + ho2', [2.000000e+13, 0.5, 42200.05]) + +# Reaction 456 +reaction('c2h5co + ho2 => c2h5cho + o2', [1.909000e+14, 0.5, 3090.11]) + +# Reaction 457 +reaction('c2h5cho + nc3h7 => c2h5co + c3h8', [1.700000e+12, 0.0, 8440.01]) + +# Reaction 458 +reaction('c2h5co + c3h8 => c2h5cho + nc3h7', [1.900000e+14, 0.0, 18789.91]) + +# Reaction 459 +reaction('c2h5cho + ic3h7 => c2h5co + c3h8', [1.700000e+12, 0.0, 8440.01]) + +# Reaction 460 +reaction('c2h5co + c3h8 => c2h5cho + ic3h7', [1.900000e+14, 0.0, 18789.91]) + +# Reaction 461 +reaction('c2h5cho + c2h3 => c2h5co + c2h4', [1.700000e+12, 0.0, 8440.01]) + +# Reaction 462 +reaction('c2h5co + c2h4 => c2h5cho + c2h3', [2.488000e+14, 0.0, 26190.01]) + +# Reaction 463 +reaction('c2h5cho + c3h5-a => c2h5co + c3h6', [1.700000e+12, 0.0, 8440.01]) + +# Reaction 464 +reaction('c2h5co + c3h6 => c2h5cho + c3h5-a', [1.000000e+13, 0.0, 28000.0]) + +# Reaction 465 +reaction('c5h10-1 => c2h5 + c3h5-a', [1.000000e+16, 0.0, 71400.1]) + +# Reaction 466 +reaction('c2h5 + c3h5-a => c5h10-1', [1.000000e+13, 0.0, 0.0]) + +# Reaction 467 +reaction('c5h10-1 + h => c5h9 + h2', [2.800000e+13, 0.0, 4000.0]) + +# Reaction 468 +reaction('c5h9 + h2 => c5h10-1 + h', [1.000000e+12, 0.0, 14000.0]) + +# Reaction 469 +reaction('c5h10-1 + o => c5h9 + oh', [2.540000e+05, 2.56, -1130.02]) + +# Reaction 470 +reaction('c5h9 + oh => c5h10-1 + o', [7.000000e+11, 0.0, 29900.1]) + +# Reaction 471 +reaction('c5h10-1 + o => pc4h9 + hco', [1.000000e+11, 0.0, 0.0]) + +# Reaction 472 +reaction('pc4h9 + hco => c5h10-1 + o', [0.000000e+00, 0.0, 0.0]) + +# Reaction 473 +reaction('c5h10-1 + o => nc3h7 + ch3co', [1.000000e+11, 0.0, 0.0]) + +# Reaction 474 +reaction('nc3h7 + ch3co => c5h10-1 + o', [0.000000e+00, 0.0, 0.0]) + +# Reaction 475 +reaction('c5h10-1 + oh => c5h9 + h2o', [6.800000e+13, 0.0, 3059.99]) + +# Reaction 476 +reaction('c5h9 + h2o => c5h10-1 + oh', [5.000000e+12, 0.0, 26500.0]) + +# Reaction 477 +reaction('c5h10-1 + oh => pc4h9 + ch2o', [1.000000e+11, 0.0, 0.0]) + +# Reaction 478 +reaction('pc4h9 + ch2o => c5h10-1 + oh', [0.000000e+00, 0.0, 0.0]) + +# Reaction 479 +reaction('c5h10-1 + oh => nc3h7 + ch3cho', [1.000000e+11, 0.0, 0.0]) + +# Reaction 480 +reaction('nc3h7 + ch3cho => c5h10-1 + oh', [0.000000e+00, 0.0, 0.0]) + +# Reaction 481 +reaction('c5h10-1 + ch3 => c5h9 + ch4', [1.000000e+11, 0.0, 7299.95]) + +# Reaction 482 +reaction('c5h9 + ch4 => c5h10-1 + ch3', [6.000000e+11, 0.0, 17900.1]) + +# Reaction 483 +reaction('h2o2 + h => h2 + ho2', [4.820000e+13, 0.0, 7950.05]) + +# Reaction 484 +reaction('h2 + ho2 => h2o2 + h', [1.875000e+12, 0.33, 24260.04]) + +# Reaction 485 +reaction('hco + o => co2 + h', [3.000000e+13, 0.0, 0.0]) + +# Reaction 486 +reaction('co2 + h => hco + o', [9.677000e+15, 0.0, 110200.05]) + +# Reaction 487 +three_body_reaction('ch3 + M => ch2 + h + M', [1.968000e+16, 0.0, 92520.08]) + +# Reaction 488 +three_body_reaction('ch2 + h + M => ch3 + M', [2.107000e+11, 1.0, -19619.98]) + +# Reaction 489 +reaction('ch3 + h => ch2 + h2', [9.000000e+13, 0.0, 15099.9]) + +# Reaction 490 +reaction('ch2 + h2 => ch3 + h', [1.818000e+13, 0.0, 10400.1]) + +# Reaction 491 +reaction('ch3 + oh => ch2 + h2o', [3.000000e+06, 2.0, 2500.0]) + +# Reaction 492 +reaction('ch2 + h2o => ch3 + oh', [2.623000e+06, 2.0, 12960.09]) + +# Reaction 493 +reaction('ch + ch4 => c2h4 + h', [6.000000e+13, 0.0, 0.0]) + +# Reaction 494 +reaction('c2h4 + h => ch + ch4', [3.573000e+14, 0.0, 55479.92]) + +# Reaction 495 +falloff_reaction('ch3oh (+ M) => ch2oh + h (+ M)', + kf=[2.690000e+16, -0.08, 98940.01], + kf0=[2.340000e+40, -6.33, 103099.9], + falloff=Troe(A=0.773, T3=693.0, T1=5333.0, T2=1e+100)) + +# Reaction 496 +falloff_reaction('ch2oh + h (+ M) => ch3oh (+ M)', + kf=[1.528000e+06, 2.58, -342.02], + kf0=[1.329000e+30, -3.67, 3817.88], + falloff=Troe(A=0.773, T3=693.0, T1=5333.0, T2=1e+100)) + +# Reaction 497 +reaction('ch3co + h => ch2co + h2', [2.000000e+13, 0.0, 0.0]) + +# Reaction 498 +reaction('ch2co + h2 => ch3co + h', [7.270000e+09, 0.0, 83039.91]) + +# Reaction 499 +reaction('ch3co + o => ch2co + oh', [2.000000e+13, 0.0, 0.0]) + +# Reaction 500 +reaction('ch2co + oh => ch3co + o', [7.270000e+09, 0.0, 83039.91]) + +# Reaction 501 +reaction('ch3co + ch3 => ch2co + ch4', [5.000000e+13, 0.0, 0.0]) + +# Reaction 502 +reaction('ch2co + ch4 => ch3co + ch3', [7.270000e+09, 0.0, 83039.91]) + +# Reaction 503 +reaction('c2h4 + o => ch2cho + h', [3.390000e+06, 1.88, 179.02]) + +# Reaction 504 +reaction('ch2cho + h => c2h4 + o', [9.481000e+06, 1.79, 16049.95]) + +# Reaction 505 +reaction('c2h5 + o => ch3cho + h', [5.000000e+13, 0.0, 0.0]) + +# Reaction 506 +reaction('ch3cho + h => c2h5 + o', [9.000000e+13, 0.0, 72679.97]) + +# Reaction 507 +reaction('c2h6 + ch => c2h5 + ch2', [1.100000e+14, 0.0, -260.04]) + +# Reaction 508 +reaction('c2h5 + ch2 => c2h6 + ch', [3.829000e+10, 0.56, 440.01]) + +# Reaction 509 +reaction('ch2oh + ch2o => ch3oh + hco', [1.292000e-01, 4.56, 6596.08]) + +# Reaction 510 +reaction('ch3oh + hco => ch2oh + ch2o', [9.630000e+03, 2.9, 13109.94]) + +# Reaction 511 +reaction('c3h6 + o2 => c3h5-t + ho2', [1.400000e+12, 0.0, 60700.05]) + +# Reaction 512 +reaction('c3h5-t + ho2 => c3h6 + o2', [1.734000e+07, 1.01, -1074.09]) + +# Reaction 513 +reaction('c2h3 + c2h4 => c4h6 + h', [5.000000e+11, 0.0, 7299.95]) + +# Reaction 514 +reaction('c4h6 + h => c2h3 + c2h4', [1.000000e+13, 0.0, 4700.05]) + +# Reaction 515 +reaction('c5h11-1 => c2h4 + nc3h7', [7.972000e+17, -1.44, 29789.91]) + +# Reaction 516 +reaction('c2h4 + nc3h7 => c5h11-1', [3.300000e+11, 0.0, 7200.05]) + +# Reaction 517 +reaction('c5h11-1 => h + c5h10-1', [3.483000e+15, -0.66, 37880.02]) + +# Reaction 518 +reaction('h + c5h10-1 => c5h11-1', [1.000000e+13, 0.0, 2900.1]) + +# Reaction 519 +reaction('c5h11-1 + o2 => c5h10-1 + ho2', [3.000000e-19, 0.0, 3000.0]) + +# Reaction 520 +reaction('c5h10-1 + ho2 => c5h11-1 + o2', [2.000000e-19, 0.0, 17500.0]) + +# Reaction 521 +reaction('c5h11-1 => c5h11-2', [3.875000e+09, 0.35, 19760.04]) + +# Reaction 522 +reaction('c5h11-2 => c5h11-1', [1.830000e+13, -0.63, 24359.94]) + +# Reaction 523 +reaction('c5h11-2 => c3h6 + c2h5', [3.026000e+21, -2.26, 30960.09]) + +# Reaction 524 +reaction('c3h6 + c2h5 => c5h11-2', [3.300000e+11, 0.0, 7200.05]) + +# Reaction 525 +reaction('c5h11-2 => c5h10-1 + h', [1.645000e+19, -1.64, 40780.11]) + +# Reaction 526 +reaction('c5h10-1 + h => c5h11-2', [1.000000e+13, 0.0, 1200.05]) + +# Reaction 527 +reaction('c5h11-2 + o2 => c5h10-1 + ho2', [4.500000e-19, 0.0, 5020.08]) + +# Reaction 528 +reaction('c5h10-1 + ho2 => c5h11-2 + o2', [2.000000e-19, 0.0, 17500.0]) + +# Reaction 529 +three_body_reaction('c2h5o + M => ch3 + ch2o + M', [1.350000e+38, -6.96, 23799.95]) + +# Reaction 530 +three_body_reaction('ch3 + ch2o + M => c2h5o + M', [6.442000e+36, -6.99, 16849.9]) + +# Reaction 531 +reaction('c2h5o + o2 => ch3cho + ho2', [4.280000e+10, 0.0, 1097.04]) + +# Reaction 532 +reaction('ch3cho + ho2 => c2h5o + o2', [3.872000e+08, 0.44, 31880.02]) + +# Reaction 533 +reaction('h2o2 + o2 => 2 ho2', [1.839000e+14, -0.66, 39549.95], + options='duplicate') + +# Reaction 534 +reaction('2 ho2 => h2o2 + o2', [1.300000e+11, 0.0, -1629.06], + options='duplicate') + +# Reaction 535 +reaction('c2h3 + o2 => ch2cho + o', [3.500000e+14, -0.61, 5260.04]) + +# Reaction 536 +reaction('ch2cho + o => c2h3 + o2', [2.589000e+12, 0.12, 6458.89]) + +# Reaction 537 +reaction('c2h5o2 => c2h5 + o2', [4.930000e+50, -11.5, 42250.0]) + +# Reaction 538 +reaction('c2h5 + o2 => c2h5o2', [1.090000e+48, -11.54, 10219.89]) + +# Reaction 539 +three_body_reaction('ch3o2 + M => ch3 + o2 + M', [4.343000e+27, -3.42, 30469.89]) + +# Reaction 540 +three_body_reaction('ch3 + o2 + M => ch3o2 + M', [5.440000e+25, -3.3, 0.0]) + +# Reaction 541 +reaction('ch3o2h => ch3o + oh', [6.310000e+14, 0.0, 42299.95]) + +# Reaction 542 +reaction('ch3o + oh => ch3o2h', [1.166000e+11, 0.6, -1771.03]) + +# Reaction 543 +reaction('c3h2 + o2 => hcco + co + h', [5.000000e+13, 0.0, 0.0]) + +# Reaction 544 +reaction('hcco + co + h => c3h2 + o2', [0.000000e+00, 0.0, 0.0]) + +# Reaction 545 +reaction('ch3o2 + ch2o => ch3o2h + hco', [1.990000e+12, 0.0, 11669.93]) + +# Reaction 546 +reaction('ch3o2h + hco => ch3o2 + ch2o', [8.504000e+12, -0.5, 7009.08]) + +# Reaction 547 +reaction('c2h4 + ch3o2 => c2h3 + ch3o2h', [1.130000e+13, 0.0, 30429.97]) + +# Reaction 548 +reaction('c2h3 + ch3o2h => c2h4 + ch3o2', [3.000000e+12, 0.0, 11500.0]) + +# Reaction 549 +reaction('ch4 + ch3o2 => ch3 + ch3o2h', [1.810000e+11, 0.0, 18479.92]) + +# Reaction 550 +reaction('ch3 + ch3o2h => ch4 + ch3o2', [3.708000e+11, -0.5, -1326.96]) + +# Reaction 551 +reaction('ch3oh + ch3o2 => ch2oh + ch3o2h', [1.810000e+12, 0.0, 13710.09]) + +# Reaction 552 +reaction('ch2oh + ch3o2h => ch3oh + ch3o2', [1.038000e+08, 1.16, 2542.07]) + +# Reaction 553 +reaction('c2h5 + ho2 => c2h5o + oh', [3.200000e+13, 0.0, 0.0]) + +# Reaction 554 +reaction('c2h5o + oh => c2h5 + ho2', [3.075000e+15, -0.32, 27489.96]) + +# Reaction 555 +reaction('ch3o2 + ch3 => 2 ch3o', [7.000000e+12, 0.0, -1000.0]) + +# Reaction 556 +reaction('2 ch3o => ch3o2 + ch3', [2.971000e+16, -0.93, 28309.99]) + +# Reaction 557 +reaction('ch3o2 + c2h5 => ch3o + c2h5o', [7.000000e+12, 0.0, -1000.0]) + +# Reaction 558 +reaction('ch3o + c2h5o => ch3o2 + c2h5', [6.569000e+16, -0.9, 31260.04]) + +# Reaction 559 +reaction('ch3o2 + ho2 => ch3o2h + o2', [1.750000e+10, 0.0, -3275.1]) + +# Reaction 560 +reaction('ch3o2h + o2 => ch3o2 + ho2', [5.156000e+13, -0.83, 34880.02]) + +# Reaction 561 +reaction('h2o2 + oh => h2o + ho2', [5.800000e+14, 0.0, 9559.99], + options='duplicate') + +# Reaction 562 +reaction('h2o + ho2 => h2o2 + oh', [9.771000e+13, 0.33, 41020.08], + options='duplicate') + +# Reaction 563 +reaction('2 ch3o2 => ch2o + ch3oh + o2', [3.110000e+14, -1.61, -1050.91]) + +# Reaction 564 +reaction('ch2o + ch3oh + o2 => 2 ch3o2', [0.000000e+00, 0.0, 0.0]) + +# Reaction 565 +reaction('2 ch3o2 => o2 + 2 ch3o', [1.400000e+16, -1.61, 1859.94]) + +# Reaction 566 +reaction('o2 + 2 ch3o => 2 ch3o2', [0.000000e+00, 0.0, 0.0]) + +# Reaction 567 +reaction('c2h6 + ch3o2 => c2h5 + ch3o2h', [1.700000e+13, 0.0, 20460.09]) + +# Reaction 568 +reaction('c2h5 + ch3o2h => c2h6 + ch3o2', [7.500000e+11, 0.0, 1280.11]) + +# Reaction 569 +reaction('o2c2h4oh => pc2h4oh + o2', [3.900000e+16, -1.0, 30000.0]) + +# Reaction 570 +reaction('pc2h4oh + o2 => o2c2h4oh', [1.200000e+11, 0.0, -1099.9]) + +# Reaction 571 +reaction('o2c2h4oh => oh + 2 ch2o', [1.250000e+10, 0.0, 18900.1]) + +# Reaction 572 +reaction('oh + 2 ch2o => o2c2h4oh', [0.000000e+00, 0.0, 0.0]) + +# Reaction 573 +reaction('c2h5o2 => c2h4o2h', [5.640000e+47, -11.44, 37320.03]) + +# Reaction 574 +reaction('c2h4o2h => c2h5o2', [6.990000e+48, -12.22, 25849.9]) + +# Reaction 575 +three_body_reaction('c2h5o + M => ch3cho + h + M', [1.160000e+35, -5.89, 25270.08]) + +# Reaction 576 +three_body_reaction('ch3cho + h + M => c2h5o + M', [3.063000e+30, -4.78, 6099.9]) + +# Reaction 577 +reaction('ch3o2 + ch3cho => ch3o2h + ch3co', [3.010000e+12, 0.0, 11929.97]) + +# Reaction 578 +reaction('ch3o2h + ch3co => ch3o2 + ch3cho', [2.519000e+13, -0.51, 8990.92]) + +# Reaction 579 +reaction('c2h3co => c2h3 + co', [2.040000e+14, -0.4, 31450.05]) + +# Reaction 580 +reaction('c2h3 + co => c2h3co', [1.510000e+11, 0.0, 4809.99]) + +# Reaction 581 +reaction('c2h3cho + oh => c2h3co + h2o', [9.240000e+06, 1.5, -962.0]) + +# Reaction 582 +reaction('c2h3co + h2o => c2h3cho + oh', [1.439000e+07, 1.53, 36450.05]) + +# Reaction 583 +reaction('c2h3cho + h => c2h3co + h2', [1.340000e+13, 0.0, 3299.95]) + +# Reaction 584 +reaction('c2h3co + h2 => c2h3cho + h', [4.820000e+12, 0.03, 25559.99]) + +# Reaction 585 +reaction('c2h3cho + o => c2h3co + oh', [5.940000e+12, 0.0, 1868.07]) + +# Reaction 586 +reaction('c2h3co + oh => c2h3cho + o', [9.384000e+11, 0.03, 22030.11]) + +# Reaction 587 +reaction('c2h3cho + ho2 => c2h3co + h2o2', [3.010000e+12, 0.0, 11929.97]) + +# Reaction 588 +reaction('c2h3co + h2o2 => c2h3cho + ho2', [2.783000e+13, -0.3, 17880.02]) + +# Reaction 589 +reaction('c2h3cho + ch3 => c2h3co + ch4', [2.608000e+06, 1.78, 5911.09]) + +# Reaction 590 +reaction('c2h3co + ch4 => c2h3cho + ch3', [2.451000e+07, 1.81, 28650.1]) + +# Reaction 591 +reaction('c2h3cho + ch3o2 => c2h3co + ch3o2h', [3.010000e+12, 0.0, 11929.97]) + +# Reaction 592 +reaction('c2h3co + ch3o2h => c2h3cho + ch3o2', [5.794000e+13, -0.47, 14859.94]) + +# Reaction 593 +reaction('c3h5o => c2h3cho + h', [1.000000e+14, 0.0, 29099.9]) + +# Reaction 594 +reaction('c2h3cho + h => c3h5o', [7.714000e+11, 0.48, 17750.0]) + +# Reaction 595 +reaction('c3h5o => c2h3 + ch2o', [2.028000e+12, 0.09, 23559.99]) + +# Reaction 596 +reaction('c2h3 + ch2o => c3h5o', [1.500000e+11, 0.0, 10599.9]) + +# Reaction 597 +reaction('c3h5o + o2 => c2h3cho + ho2', [1.000000e+12, 0.0, 6000.0]) + +# Reaction 598 +reaction('c2h3cho + ho2 => c3h5o + o2', [1.288000e+11, 0.0, 32000.0]) + +# Reaction 599 +reaction('c3h5-a + ho2 => c3h5o + oh', [7.000000e+12, 0.0, -1000.0]) + +# Reaction 600 +reaction('c3h5o + oh => c3h5-a + ho2', [2.041000e+13, -0.16, 12260.04]) + +# Reaction 601 +reaction('c3h5-a + ch3o2 => c3h5o + ch3o', [7.000000e+12, 0.0, -1000.0]) + +# Reaction 602 +reaction('c3h5o + ch3o => c3h5-a + ch3o2', [1.994000e+15, -0.74, 17020.08]) + +# Reaction 603 +reaction('c3h6 + ho2 => c3h6o1-2 + oh', [1.290000e+12, 0.0, 14900.1]) + +# Reaction 604 +reaction('c3h6o1-2 + oh => c3h6 + ho2', [1.000000e-10, 0.0, 0.0]) + +# Reaction 605 +reaction('c3h6 + ch3o2 => c3h5-a + ch3o2h', [3.240000e+11, 0.0, 14900.1]) + +# Reaction 606 +reaction('c3h5-a + ch3o2h => c3h6 + ch3o2', [2.000000e+10, 0.0, 15000.0]) + +# Reaction 607 +reaction('c3h6o1-2 => c2h4 + ch2o', [6.000000e+14, 0.0, 60000.0]) + +# Reaction 608 +reaction('c2h4 + ch2o => c3h6o1-2', [2.970000e+11, 0.0, 50000.0]) + +# Reaction 609 +reaction('c3h6o1-2 + oh => ch2o + c2h3 + h2o', [5.000000e+12, 0.0, 0.0]) + +# Reaction 610 +reaction('ch2o + c2h3 + h2o => c3h6o1-2 + oh', 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0.0, 0.0]) + +# Reaction 832 +reaction('c2h2 + hco => c3h2 + oh', [2.907000e+20, -1.39, 78520.08]) + +# Reaction 833 +reaction('c3h5-a => c3h4-a + h', [6.663000e+15, -0.43, 63219.89]) + +# Reaction 834 +reaction('c3h4-a + h => c3h5-a', [2.400000e+11, 0.69, 3006.93]) + +# Reaction 835 +reaction('c3h5-t => c3h4-a + h', [3.508000e+14, -0.44, 40890.06]) + +# Reaction 836 +reaction('c3h4-a + h => c3h5-t', [8.500000e+12, 0.0, 2000.0]) + +# Reaction 837 +reaction('c3h4-a + h => c3h3 + h2', [2.000000e+07, 2.0, 5000.0]) + +# Reaction 838 +reaction('c3h3 + h2 => c3h4-a + h', [3.235000e+06, 1.97, 23359.94]) + +# Reaction 839 +reaction('c3h4-a + ch3 => c3h3 + ch4', [3.670000e-02, 4.01, 6830.07]) + +# Reaction 840 +reaction('c3h3 + ch4 => c3h4-a + ch3', [1.551000e-01, 3.98, 25669.93]) + +# Reaction 841 +reaction('c3h4-a + c3h5-a => c3h3 + c3h6', [2.000000e+11, 0.0, 7700.05]) + +# Reaction 842 +reaction('c3h3 + c3h6 => c3h4-a + c3h5-a', [2.644000e+19, -2.71, 42140.06]) + +# Reaction 843 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c3h5-a + o2', [0.000000e+00, 0.0, 0.0]) + +# Reaction 901 +reaction('hcco + o2 => co2 + hco', [2.400000e+11, 0.0, -853.97]) + +# Reaction 902 +reaction('co2 + hco => hcco + o2', [1.474000e+14, 0.0, 133599.9]) + +# Reaction 903 +reaction('c3h6 + h => c3h5-s + h2', [8.040000e+05, 2.5, 12280.11]) + +# Reaction 904 +reaction('c3h5-s + h2 => c3h6 + h', [2.393000e+03, 2.99, 5875.96]) + +# Reaction 905 +reaction('ch2co + oh => ch2oh + co', [3.730000e+12, 0.0, -1012.91]) + +# Reaction 906 +reaction('ch2oh + co => ch2co + oh', [9.430000e+06, 1.66, 27489.96]) + +# Reaction 907 +reaction('ch3 + o2 => ch2o + oh', [7.470000e+11, 0.0, 14250.0]) + +# Reaction 908 +reaction('ch2o + oh => ch3 + o2', [7.778000e+11, 0.0, 67770.08]) + +# Reaction 909 +reaction('c2h4 + h2 => 2 ch3', [3.767000e+12, 0.83, 84710.09]) + +# Reaction 910 +reaction('2 ch3 => c2h4 + h2', [1.000000e+14, 0.0, 32000.0]) + +# Reaction 911 +reaction('c3h5-t + o2 => ch2o + ch3co', [3.710000e+25, -3.96, 7043.02]) + +# Reaction 912 +reaction('ch2o + ch3co => c3h5-t + o2', [1.872000e+27, -4.43, 101200.05]) + +# Reaction 913 +reaction('ic3h7 + oh => c3h6 + h2o', [2.410000e+13, 0.0, 0.0]) + +# Reaction 914 +reaction('c3h6 + h2o => ic3h7 + oh', [2.985000e+12, 0.57, 83820.03]) + +# Reaction 915 +reaction('ic3h7 + o => ch3coch3 + h', [4.818000e+13, 0.0, 0.0]) + +# Reaction 916 +reaction('ch3coch3 + h => ic3h7 + o', [1.293000e+16, -0.19, 79380.02]) + +# Reaction 917 +reaction('ic3h7 + o => ch3cho + ch3', [4.818000e+13, 0.0, 0.0]) + +# Reaction 918 +reaction('ch3cho + ch3 => ic3h7 + o', [1.279000e+11, 0.8, 86479.92]) + +# Reaction 919 +reaction('c3h6 + h => c3h5-t + h2', [4.050000e+05, 2.5, 9793.98]) + +# Reaction 920 +reaction('c3h5-t + h2 => c3h6 + h', [2.761000e+02, 3.19, 5500.0]) + +# Reaction 921 +reaction('c3h6 => c3h5-t + h', [5.620000e+71, -16.58, 139299.95]) + +# Reaction 922 +reaction('c3h5-t + h => c3h6', [2.032000e+64, -14.89, 27549.95]) + +# Reaction 923 +reaction('nc3h7cho + o2 => nc3h7co + ho2', [2.000000e+13, 0.5, 42200.05]) + +# Reaction 924 +reaction('nc3h7co + ho2 => nc3h7cho + o2', [1.000000e+07, 0.5, 4000.0]) + +# Reaction 925 +reaction('nc3h7cho + oh => nc3h7co + h2o', [1.000000e+13, 0.0, 0.0]) + +# Reaction 926 +reaction('nc3h7co + h2o => nc3h7cho + oh', [2.000000e+13, 0.0, 37000.0]) + +# Reaction 927 +reaction('nc3h7cho + h => nc3h7co + h2', [4.000000e+13, 0.0, 4200.05]) + +# Reaction 928 +reaction('nc3h7co + h2 => nc3h7cho + h', [1.800000e+13, 0.0, 24000.0]) + +# Reaction 929 +reaction('nc3h7cho + o => nc3h7co + oh', [5.000000e+12, 0.0, 1789.91]) + +# Reaction 930 +reaction('nc3h7co + oh => nc3h7cho + o', [1.000000e+12, 0.0, 19000.0]) + +# Reaction 931 +reaction('nc3h7cho + ho2 => nc3h7co + h2o2', [2.800000e+12, 0.0, 13599.9]) + +# Reaction 932 +reaction('nc3h7co + h2o2 => nc3h7cho + ho2', [1.000000e+12, 0.0, 10000.0]) + +# Reaction 933 +reaction('nc3h7cho + ch3 => nc3h7co + ch4', [1.700000e+12, 0.0, 8440.01]) + +# Reaction 934 +reaction('nc3h7co + ch4 => nc3h7cho + ch3', [1.500000e+13, 0.0, 28000.0]) + +# Reaction 935 +reaction('nc3h7cho + ch3o => nc3h7co + ch3oh', [1.150000e+11, 0.0, 1280.11]) + +# Reaction 936 +reaction('nc3h7co + ch3oh => nc3h7cho + ch3o', [3.000000e+11, 0.0, 18000.0]) + +# Reaction 937 +reaction('nc3h7cho + ch3o2 => nc3h7co + ch3o2h', [1.000000e+12, 0.0, 9500.0]) + +# Reaction 938 +reaction('nc3h7co + ch3o2h => nc3h7cho + ch3o2', [2.500000e+10, 0.0, 10000.0]) + +# Reaction 939 +reaction('nc3h7cho + oh => c3h6cho-2 + h2o', [4.670000e+07, 1.61, -34.89]) + +# Reaction 940 +reaction('c3h6cho-2 + h2o => nc3h7cho + oh', [8.057000e+05, 1.91, 21940.01]) + +# Reaction 941 +reaction('nc3h7cho + ho2 => c3h6cho-2 + h2o2', [1.475000e+04, 2.6, 13909.89]) + +# Reaction 942 +reaction('c3h6cho-2 + h2o2 => nc3h7cho + ho2', [1.511000e+03, 2.57, 4424.0]) + +# Reaction 943 +reaction('nc3h7cho + ch3o2 => c3h6cho-2 + ch3o2h', [9.630000e+03, 2.6, 13909.89]) + +# Reaction 944 +reaction('c3h6cho-2 + ch3o2h => nc3h7cho + ch3o2', [4.053000e+03, 2.4, 3704.11]) + +# Reaction 945 +reaction('nc3h7co => nc3h7 + co', [1.000000e+11, 0.0, 9599.9]) + +# Reaction 946 +reaction('nc3h7 + co => nc3h7co', [1.000000e+11, 0.0, 0.0]) + +# Reaction 947 +reaction('ch3chco + oh => c2h5 + co2', [1.730000e+12, 0.0, -1010.04]) + +# Reaction 948 +reaction('c2h5 + co2 => ch3chco + oh', [0.000000e+00, 0.0, 0.0]) + +# Reaction 949 +reaction('ch3chco + h => c2h5 + co', [4.400000e+12, 0.0, 1458.89]) + +# Reaction 950 +reaction('c2h5 + co => ch3chco + h', [0.000000e+00, 0.0, 0.0]) + +# Reaction 951 +reaction('ch3chco + o => ch3cho + co', [3.200000e+12, 0.0, -436.9]) + +# Reaction 952 +reaction('ch3cho + co => ch3chco + o', [0.000000e+00, 0.0, 0.0]) + +# Reaction 953 +reaction('ch2ch2coch3 => c2h4 + ch3co', [5.970000e+12, 0.0, 20729.92]) + +# Reaction 954 +reaction('c2h4 + ch3co => ch2ch2coch3', [2.110000e+11, 0.0, 7349.9]) + +# Reaction 955 +reaction('c2h5coch2 => ch2co + c2h5', [1.570000e+13, 0.0, 30000.0]) + +# Reaction 956 +reaction('ch2co + c2h5 => c2h5coch2', [2.110000e+11, 0.0, 7349.9]) + +# Reaction 957 +reaction('c3h6cho-2 => c3h6 + hco', [8.249000e+12, -0.18, 21900.1]) + +# Reaction 958 +reaction('c3h6 + hco => c3h6cho-2', [1.000000e+11, 0.0, 6000.0]) + +# Reaction 959 +reaction('c2h5coc2h4p => c2h5co + c2h4', [1.548000e+17, -1.46, 27840.11]) + +# Reaction 960 +reaction('c2h5co + c2h4 => c2h5coc2h4p', [7.000000e+10, 0.0, 9599.9]) + +# Reaction 961 +reaction('nc3h7coch2 => nc3h7 + ch2co', [1.226000e+18, -1.4, 43450.05]) + +# Reaction 962 +reaction('nc3h7 + ch2co => nc3h7coch2', [1.000000e+11, 0.0, 11599.9]) + +# Reaction 963 +reaction('nc4h9cho + o2 => nc4h9co + ho2', [2.000000e+13, 0.5, 42200.05]) + +# Reaction 964 +reaction('nc4h9co + ho2 => nc4h9cho + o2', [1.000000e+07, 0.0, 40000.0]) + +# Reaction 965 +reaction('nc4h9cho + oh => nc4h9co + h2o', [1.000000e+13, 0.0, 0.0]) + +# Reaction 966 +reaction('nc4h9co + h2o => nc4h9cho + oh', [2.000000e+13, 0.0, 37000.0]) + +# Reaction 967 +reaction('nc4h9cho + h => nc4h9co + h2', [4.000000e+13, 0.0, 4200.05]) + +# Reaction 968 +reaction('nc4h9co + h2 => nc4h9cho + h', [1.800000e+13, 0.0, 24000.0]) + +# Reaction 969 +reaction('nc4h9cho + o => nc4h9co + oh', [5.000000e+12, 0.0, 1789.91]) + +# Reaction 970 +reaction('nc4h9co + oh => nc4h9cho + o', [1.000000e+12, 0.0, 19000.0]) + +# Reaction 971 +reaction('nc4h9cho + ho2 => nc4h9co + h2o2', [2.800000e+12, 0.0, 13599.9]) + +# Reaction 972 +reaction('nc4h9co + h2o2 => nc4h9cho + ho2', [1.000000e+12, 0.0, 10000.0]) + +# Reaction 973 +reaction('nc4h9cho + ch3 => nc4h9co + ch4', [1.700000e+12, 0.0, 8440.01]) + +# Reaction 974 +reaction('nc4h9co + ch4 => nc4h9cho + ch3', [1.500000e+13, 0.0, 28000.0]) + +# Reaction 975 +reaction('nc4h9cho + ch3o => nc4h9co + ch3oh', [1.150000e+11, 0.0, 1280.11]) + +# Reaction 976 +reaction('nc4h9co + ch3oh => nc4h9cho + ch3o', [3.000000e+11, 0.0, 18000.0]) + +# Reaction 977 +reaction('nc4h9cho + ch3o2 => nc4h9co + ch3o2h', [1.000000e+12, 0.0, 9500.0]) + +# Reaction 978 +reaction('nc4h9co + ch3o2h => nc4h9cho + ch3o2', [2.500000e+10, 0.0, 10000.0]) + +# Reaction 979 +reaction('nc4h9co => pc4h9 + co', [1.000000e+11, 0.0, 9599.9]) + +# Reaction 980 +reaction('pc4h9 + co => nc4h9co', [1.000000e+11, 0.0, 0.0]) + +# Reaction 981 +reaction('hoch2o => ch2o + oh', [8.545000e+13, -0.1, 17530.11]) + +# Reaction 982 +reaction('ch2o + oh => hoch2o', [2.600000e+12, 0.0, -614.01]) + +# Reaction 983 +reaction('hoch2o => hocho + h', [1.000000e+14, 0.0, 14900.1]) + +# Reaction 984 +reaction('hocho + h => hoch2o', [5.917000e+11, 0.64, 12299.95]) + +# Reaction 985 +three_body_reaction('hocho + M => co + h2o + M', [2.300000e+13, 0.0, 50000.0]) + +# Reaction 986 +three_body_reaction('co + h2o + M => hocho + M', [1.422000e+10, 0.46, 46840.11]) + +# Reaction 987 +three_body_reaction('hocho + M => co2 + h2 + M', [1.500000e+16, 0.0, 57000.0]) + +# Reaction 988 +three_body_reaction('co2 + h2 + M => hocho + M', [2.399000e+14, 0.46, 61020.08]) + +# Reaction 989 +reaction('hocho => hco + oh', [4.593000e+18, -0.46, 108299.95]) + +# Reaction 990 +reaction('hco + oh => hocho', [1.000000e+14, 0.0, 0.0]) + +# Reaction 991 +reaction('hocho + oh => h2o + co2 + h', [2.620000e+06, 2.06, 916.11]) + +# Reaction 992 +reaction('h2o + co2 + h => hocho + oh', [0.000000e+00, 0.0, 0.0]) + +# Reaction 993 +reaction('hocho + oh => h2o + co + oh', [1.850000e+07, 1.51, -962.0]) + +# Reaction 994 +reaction('h2o + co + oh => hocho + oh', [0.000000e+00, 0.0, 0.0]) + +# Reaction 995 +reaction('hocho + h => h2 + co2 + h', [4.240000e+06, 2.1, 4868.07]) + +# Reaction 996 +reaction('h2 + co2 + h => hocho + h', [0.000000e+00, 0.0, 0.0]) + +# Reaction 997 +reaction('hocho + h => h2 + co + oh', [6.030000e+13, -0.35, 2988.05]) + +# Reaction 998 +reaction('h2 + co + oh => hocho + h', [0.000000e+00, 0.0, 0.0]) + +# Reaction 999 +reaction('hocho + ch3 => ch4 + co + oh', [3.900000e-07, 5.8, 2200.05]) + +# Reaction 1000 +reaction('ch4 + co + oh => hocho + ch3', [0.000000e+00, 0.0, 0.0]) + +# Reaction 1001 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o2', [0.000000e+00, 0.0, 0.0]) + +# Reaction 1013 +reaction('ch2(s) + h2 => ch3 + h', [7.000000e+13, 0.0, 0.0]) + +# Reaction 1014 +reaction('ch3 + h => ch2(s) + h2', [2.482000e+17, -0.89, 16130.02]) + +# Reaction 1015 +reaction('ch2(s) + h => ch + h2', [3.000000e+13, 0.0, 0.0]) + +# Reaction 1016 +reaction('ch + h2 => ch2(s) + h', [1.509000e+16, -0.89, 14419.93]) + +# Reaction 1017 +reaction('ch2(s) + o => co + 2 h', [3.000000e+13, 0.0, 0.0]) + +# Reaction 1018 +reaction('co + 2 h => ch2(s) + o', [0.000000e+00, 0.0, 0.0]) + +# Reaction 1019 +reaction('ch2(s) + oh => ch2o + h', [3.000000e+13, 0.0, 0.0]) + +# Reaction 1020 +reaction('ch2o + h => ch2(s) + oh', [3.194000e+18, -0.89, 87859.94]) + +# Reaction 1021 +reaction('ch2(s) + co2 => ch2o + co', [3.000000e+12, 0.0, 0.0]) + +# Reaction 1022 +reaction('ch2o + co => ch2(s) + co2', [2.852000e+15, -0.89, 65520.08]) + +# Reaction 1023 +reaction('ch2(s) + ch3 => c2h4 + h', [2.000000e+13, 0.0, 0.0]) + +# Reaction 1024 +reaction('c2h4 + h => ch2(s) + ch3', [2.671000e+15, -0.06, 68840.11]) + +# Reaction 1025 +reaction('ch2(s) + ch2co => c2h4 + co', [1.600000e+14, 0.0, 0.0]) + +# Reaction 1026 +reaction('c2h4 + co => ch2(s) + ch2co', [4.596000e+15, -0.06, 105599.9]) + +# Reaction 1027 +reaction('c6h13-1 + o2 => c6h12-1 + ho2', [3.000000e-19, 0.0, 3000.0]) + +# Reaction 1028 +reaction('c6h12-1 + ho2 => c6h13-1 + o2', [2.000000e-19, 0.0, 17500.0]) + +# Reaction 1029 +reaction('c6h13-1 => c2h4 + pc4h9', [5.446000e+17, -1.29, 29580.07]) + +# Reaction 1030 +reaction('c2h4 + pc4h9 => c6h13-1', [3.300000e+11, 0.0, 7200.05]) + +# Reaction 1031 +reaction('c6h13-1 => c6h12-1 + h', [2.091000e+16, -0.89, 37950.05]) + +# Reaction 1032 +reaction('c6h12-1 + h => c6h13-1', [1.000000e+13, 0.0, 2900.1]) + +# Reaction 1033 +reaction('c6h12-1 + oh => c6h11 + h2o', [3.000000e+13, 0.0, 1229.92]) + +# Reaction 1034 +reaction('c6h11 + h2o => c6h12-1 + oh', [9.764000e+14, -0.13, 39260.04]) + +# Reaction 1035 +reaction('c6h12-1 + h => c6h11 + h2', [3.700000e+13, 0.0, 3900.1]) + +# Reaction 1036 +reaction('c6h11 + h2 => c6h12-1 + h', [2.781000e+14, -0.13, 26770.08]) + +# Reaction 1037 +reaction('c6h12-1 + ch3 => c6h11 + ch4', [1.000000e+12, 0.0, 7299.95]) + +# Reaction 1038 +reaction('c6h11 + ch4 => c6h12-1 + ch3', [1.964000e+14, -0.13, 30650.1]) + +# Reaction 1039 +reaction('c6h12-1 + o => c6h11 + oh', [2.120000e+11, 0.13, 9125.0]) + +# Reaction 1040 +reaction('c6h11 + oh => c6h12-1 + o', [7.000000e+11, 0.0, 29900.1]) + +# Reaction 1041 +reaction('c6h12-1 + oh => c5h11-1 + ch2o', [1.000000e+11, 0.0, -4000.0]) + +# Reaction 1042 +reaction('c5h11-1 + ch2o => c6h12-1 + oh', [0.000000e+00, 0.0, 0.0]) + +# Reaction 1043 +reaction('c6h12-1 + o => c5h11-1 + hco', [1.000000e+11, 0.0, -1049.95]) + +# Reaction 1044 +reaction('c5h11-1 + hco => c6h12-1 + o', [0.000000e+00, 0.0, 0.0]) + +# Reaction 1045 +reaction('c6h11 => c3h6 + c3h5-a', [2.500000e+13, 0.0, 45000.0]) + +# Reaction 1046 +reaction('c3h6 + c3h5-a => c6h11', [1.000000e+10, 0.0, 17000.0]) + +# Reaction 1047 +reaction('c6h11 => c4h8-1 + c2h3', [2.500000e-17, 0.0, 45000.0]) + +# Reaction 1048 +reaction('c4h8-1 + c2h3 => c6h11', [1.500000e-20, 0.0, 7400.1]) + +# Reaction 1049 +reaction('c6h11 => c4h7 + c2h4', [2.500000e-17, 0.0, 45000.0]) + +# Reaction 1050 +reaction('c4h7 + c2h4 => c6h11', [1.500000e-20, 0.0, 7400.1]) + +# Reaction 1051 +reaction('c6h12-1 => nc3h7 + c3h5-a', [1.000000e+16, 0.0, 71000.0]) + +# Reaction 1052 +reaction('nc3h7 + c3h5-a => c6h12-1', [1.000000e+13, 0.0, 0.0]) + +# Reaction 1053 +reaction('nc7h16 => h + c7h15-1', [1.340000e+88, -21.17, 142799.95]) + +# Reaction 1054 +reaction('h + c7h15-1 => nc7h16', [3.374000e+82, -20.22, 39609.94]) + +# Reaction 1055 +reaction('nc7h16 => h + c7h15-2', [6.500000e+87, -21.01, 139500.0]) + +# Reaction 1056 +reaction('h + c7h15-2 => nc7h16', [5.207000e+80, -19.67, 38890.06]) + +# Reaction 1057 +reaction('nc7h16 => h + c7h15-3', [6.500000e+87, -21.01, 139500.0]) + +# Reaction 1058 +reaction('h + c7h15-3 => nc7h16', [5.207000e+80, -19.67, 38890.06]) + +# Reaction 1059 +reaction('nc7h16 => h + c7h15-4', [3.250000e+87, -21.01, 139500.0]) + +# Reaction 1060 +reaction('h + c7h15-4 => nc7h16', [5.187000e+80, -19.67, 38890.06]) + +# Reaction 1061 +reaction('nc7h16 => c6h13-1 + ch3', [2.925000e+73, -16.61, 118900.1]) + +# Reaction 1062 +reaction('c6h13-1 + ch3 => nc7h16', [8.348000e+66, -15.75, 31830.07]) + +# Reaction 1063 +reaction('nc7h16 => c5h11-1 + c2h5', [8.100000e+77, -17.62, 120400.1]) + +# Reaction 1064 +reaction('c5h11-1 + c2h5 => nc7h16', [8.297000e+67, -16.05, 32349.9]) + +# Reaction 1065 +reaction('nc7h16 => pc4h9 + nc3h7', [1.415000e+78, -17.71, 120700.05]) + +# Reaction 1066 +reaction('pc4h9 + nc3h7 => nc7h16', [1.363000e+68, -16.11, 32460.09]) + +# Reaction 1067 +reaction('nc7h16 + h => c7h15-1 + h2', [1.880000e+05, 2.75, 6280.11]) + +# Reaction 1068 +reaction('c7h15-1 + h2 => nc7h16 + h', [8.926000e+03, 2.7, 10549.95]) + +# Reaction 1069 +reaction('nc7h16 + h => c7h15-2 + h2', [2.600000e+06, 2.4, 4471.08]) + +# Reaction 1070 +reaction('c7h15-2 + h2 => nc7h16 + h', [3.928000e+03, 2.74, 11260.04]) + +# Reaction 1071 +reaction('nc7h16 + h => c7h15-3 + h2', [2.600000e+06, 2.4, 4471.08]) + +# Reaction 1072 +reaction('c7h15-3 + h2 => nc7h16 + h', [3.928000e+03, 2.74, 11260.04]) + +# Reaction 1073 +reaction('nc7h16 + h => c7h15-4 + h2', [1.300000e+06, 2.4, 4471.08]) + +# Reaction 1074 +reaction('c7h15-4 + h2 => nc7h16 + h', [3.913000e+03, 2.74, 11260.04]) + +# Reaction 1075 +reaction('nc7h16 + o => c7h15-1 + oh', [1.930000e+05, 2.68, 3716.06]) + +# Reaction 1076 +reaction('c7h15-1 + oh => nc7h16 + o', [4.025000e+03, 2.63, 5892.93]) + +# Reaction 1077 +reaction('nc7h16 + o => c7h15-2 + oh', [9.540000e+04, 2.71, 2106.12]) + +# Reaction 1078 +reaction('c7h15-2 + oh => nc7h16 + o', [6.330000e+01, 3.05, 6798.04]) + +# Reaction 1079 +reaction('nc7h16 + o => c7h15-3 + oh', [9.540000e+04, 2.71, 2106.12]) + +# Reaction 1080 +reaction('c7h15-3 + oh => nc7h16 + o', [6.330000e+01, 3.05, 6798.04]) + +# Reaction 1081 +reaction('nc7h16 + o => c7h15-4 + oh', [4.770000e+04, 2.71, 2106.12]) + +# Reaction 1082 +reaction('c7h15-4 + oh => nc7h16 + o', [6.306000e+01, 3.05, 6798.04]) + +# Reaction 1083 +reaction('nc7h16 + oh => c7h15-1 + h2o', [1.050000e+10, 0.97, 1590.11]) + +# Reaction 1084 +reaction('c7h15-1 + h2o => nc7h16 + oh', [1.500000e+10, 1.05, 23330.07]) + +# Reaction 1085 +reaction('nc7h16 + oh => c7h15-2 + h2o', [9.400000e+07, 1.61, -34.89]) + +# Reaction 1086 +reaction('c7h15-2 + h2o => nc7h16 + oh', [6.148000e+05, 1.95, 21909.89]) + +# Reaction 1087 +reaction('nc7h16 + oh => c7h15-3 + h2o', [9.400000e+07, 1.61, -34.89]) + +# Reaction 1088 +reaction('c7h15-3 + h2o => nc7h16 + oh', [6.148000e+05, 1.95, 21909.89]) + +# Reaction 1089 +reaction('nc7h16 + oh => c7h15-4 + h2o', [4.700000e+07, 1.61, -34.89]) + +# Reaction 1090 +reaction('c7h15-4 + h2o => nc7h16 + oh', [6.125000e+05, 1.95, 21909.89]) + +# Reaction 1091 +reaction('nc7h16 + ho2 => c7h15-1 + h2o2', [1.680000e+13, 0.0, 20440.01]) + +# Reaction 1092 +reaction('c7h15-1 + h2o2 => nc7h16 + ho2', [2.050000e+13, -0.38, 8398.9]) + +# Reaction 1093 +reaction('nc7h16 + ho2 => c7h15-2 + h2o2', [1.120000e+13, 0.0, 17690.01]) + +# Reaction 1094 +reaction('c7h15-2 + h2o2 => nc7h16 + ho2', [4.348000e+11, 0.01, 8164.91]) + +# Reaction 1095 +reaction('nc7h16 + ho2 => c7h15-3 + h2o2', [1.120000e+13, 0.0, 17690.01]) + +# Reaction 1096 +reaction('c7h15-3 + h2o2 => nc7h16 + ho2', [4.348000e+11, 0.01, 8164.91]) + +# Reaction 1097 +reaction('nc7h16 + ho2 => c7h15-4 + h2o2', [5.600000e+12, 0.0, 17690.01]) + +# Reaction 1098 +reaction('c7h15-4 + h2o2 => nc7h16 + ho2', [4.332000e+11, 0.01, 8164.91]) + +# Reaction 1099 +reaction('nc7h16 + ch3 => c7h15-1 + ch4', [9.040000e-01, 3.65, 7153.92]) + +# Reaction 1100 +reaction('c7h15-1 + ch4 => nc7h16 + ch3', [1.121000e+00, 3.6, 11909.89]) + +# Reaction 1101 +reaction('nc7h16 + ch3 => c7h15-2 + ch4', [5.410000e+04, 2.26, 7287.05]) + +# Reaction 1102 +reaction('c7h15-2 + ch4 => nc7h16 + ch3', [2.135000e+03, 2.6, 14549.95]) + +# Reaction 1103 +reaction('nc7h16 + ch3 => c7h15-3 + ch4', [5.410000e+04, 2.26, 7287.05]) + +# Reaction 1104 +reaction('c7h15-3 + ch4 => nc7h16 + ch3', [2.135000e+03, 2.6, 14549.95]) + +# Reaction 1105 +reaction('nc7h16 + ch3 => c7h15-4 + ch4', [2.705000e+04, 2.26, 7287.05]) + +# Reaction 1106 +reaction('c7h15-4 + ch4 => nc7h16 + ch3', [2.127000e+03, 2.6, 14549.95]) + +# Reaction 1107 +reaction('nc7h16 + o2 => c7h15-1 + ho2', [6.000000e+13, 0.0, 52799.95]) + +# Reaction 1108 +reaction('c7h15-1 + ho2 => nc7h16 + o2', [5.175000e+10, 0.28, -406.07]) + +# Reaction 1109 +reaction('nc7h16 + o2 => c7h15-2 + ho2', [4.000000e+13, 0.0, 50150.1]) + +# Reaction 1110 +reaction('c7h15-2 + ho2 => nc7h16 + o2', [1.098000e+09, 0.67, -541.11]) + +# Reaction 1111 +reaction('nc7h16 + o2 => c7h15-3 + ho2', [4.000000e+13, 0.0, 50150.1]) + +# Reaction 1112 +reaction('c7h15-3 + ho2 => nc7h16 + o2', [1.098000e+09, 0.67, -541.11]) + +# Reaction 1113 +reaction('nc7h16 + o2 => c7h15-4 + ho2', [2.000000e+13, 0.0, 50150.1]) + +# Reaction 1114 +reaction('c7h15-4 + ho2 => nc7h16 + o2', [1.094000e+09, 0.67, -541.11]) + +# Reaction 1115 +reaction('nc7h16 + c2h5 => c7h15-1 + c2h6', [1.000000e+11, 0.0, 13400.1]) + +# Reaction 1116 +reaction('c7h15-1 + c2h6 => nc7h16 + c2h5', [3.200000e+11, 0.0, 12299.95]) + +# Reaction 1117 +reaction('nc7h16 + c2h5 => c7h15-2 + c2h6', [1.000000e+11, 0.0, 10400.1]) + +# Reaction 1118 +reaction('c7h15-2 + c2h6 => nc7h16 + c2h5', [1.000000e+11, 0.0, 12900.1]) + +# Reaction 1119 +reaction('nc7h16 + c2h5 => c7h15-3 + c2h6', [1.000000e+11, 0.0, 10400.1]) + +# Reaction 1120 +reaction('c7h15-3 + c2h6 => nc7h16 + c2h5', [1.000000e+11, 0.0, 12900.1]) + +# Reaction 1121 +reaction('nc7h16 + c2h5 => c7h15-4 + c2h6', [5.000000e+10, 0.0, 10400.1]) + +# Reaction 1122 +reaction('c7h15-4 + c2h6 => nc7h16 + c2h5', [1.000000e+11, 0.0, 12900.1]) + +# Reaction 1123 +reaction('nc7h16 + ch3o => c7h15-1 + ch3oh', [3.160000e+11, 0.0, 7000.0]) + +# Reaction 1124 +reaction('c7h15-1 + ch3oh => nc7h16 + ch3o', [1.200000e+10, 0.0, 9200.05]) + +# Reaction 1125 +reaction('nc7h16 + ch3o => c7h15-2 + ch3oh', [2.190000e+11, 0.0, 5000.0]) + +# Reaction 1126 +reaction('c7h15-2 + ch3oh => nc7h16 + ch3o', [8.900000e+09, 0.0, 7200.05]) + +# Reaction 1127 +reaction('nc7h16 + ch3o => c7h15-3 + ch3oh', [2.190000e+11, 0.0, 5000.0]) + +# Reaction 1128 +reaction('c7h15-3 + ch3oh => nc7h16 + ch3o', [8.900000e+09, 0.0, 7200.05]) + +# Reaction 1129 +reaction('nc7h16 + ch3o => c7h15-4 + ch3oh', [1.095000e+11, 0.0, 5000.0]) + +# Reaction 1130 +reaction('c7h15-4 + ch3oh => nc7h16 + ch3o', [8.900000e+09, 0.0, 7200.05]) + +# Reaction 1131 +reaction('nc7h16 + c2h3 => c7h15-1 + c2h4', [1.000000e+12, 0.0, 18000.0]) + +# Reaction 1132 +reaction('c7h15-1 + c2h4 => nc7h16 + c2h3', [2.570000e+12, 0.0, 25400.1]) + +# Reaction 1133 +reaction('nc7h16 + c2h3 => c7h15-2 + c2h4', [8.000000e+11, 0.0, 16799.95]) + +# Reaction 1134 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+ ch3o2', [2.376000e+11, 0.0, 3700.05]) + +# Reaction 1145 +reaction('nc7h16 + ch3o2 => c7h15-4 + ch3o2h', [4.032000e+12, 0.0, 17700.05]) + +# Reaction 1146 +reaction('c7h15-4 + ch3o2h => nc7h16 + ch3o2', [2.376000e+11, 0.0, 3700.05]) + +# Reaction 1147 +reaction('nc7h16 + c7h15o2-1 => c7h15-1 + c7h15o2h-1', [1.210000e+13, 0.0, 20429.97]) + +# Reaction 1148 +reaction('c7h15-1 + c7h15o2h-1 => nc7h16 + c7h15o2-1', [1.440000e+10, 0.0, 15000.0]) + +# Reaction 1149 +reaction('nc7h16 + c7h15o2-2 => c7h15-1 + c7h15o2h-2', [1.210000e+13, 0.0, 20429.97]) + +# Reaction 1150 +reaction('c7h15-1 + c7h15o2h-2 => nc7h16 + c7h15o2-2', [1.440000e+10, 0.0, 15000.0]) + +# Reaction 1151 +reaction('nc7h16 + c7h15o2-3 => c7h15-1 + c7h15o2h-3', [1.210000e+13, 0.0, 20429.97]) + +# Reaction 1152 +reaction('c7h15-1 + c7h15o2h-3 => nc7h16 + c7h15o2-3', [1.440000e+10, 0.0, 15000.0]) + +# Reaction 1153 +reaction('nc7h16 + c7h15o2-1 => c7h15-2 + c7h15o2h-1', [8.064000e+12, 0.0, 17700.05]) + +# Reaction 1154 +reaction('c7h15-2 + c7h15o2h-1 => nc7h16 + c7h15o2-1', [1.440000e+10, 0.0, 15000.0]) + +# Reaction 1155 +reaction('nc7h16 + c7h15o2-2 => c7h15-2 + c7h15o2h-2', [8.064000e+12, 0.0, 17700.05]) + +# Reaction 1156 +reaction('c7h15-2 + c7h15o2h-2 => nc7h16 + c7h15o2-2', [1.440000e+10, 0.0, 15000.0]) + +# Reaction 1157 +reaction('nc7h16 + c7h15o2-3 => c7h15-2 + c7h15o2h-3', [8.064000e+12, 0.0, 17700.05]) + +# Reaction 1158 +reaction('c7h15-2 + c7h15o2h-3 => nc7h16 + c7h15o2-3', [1.440000e+10, 0.0, 15000.0]) + +# Reaction 1159 +reaction('nc7h16 + c7h15o2-1 => c7h15-3 + c7h15o2h-1', [8.064000e+12, 0.0, 17700.05]) + +# Reaction 1160 +reaction('c7h15-3 + c7h15o2h-1 => nc7h16 + c7h15o2-1', [1.440000e+10, 0.0, 15000.0]) + +# Reaction 1161 +reaction('nc7h16 + c7h15o2-2 => c7h15-3 + c7h15o2h-2', [8.064000e+12, 0.0, 17700.05]) + +# Reaction 1162 +reaction('c7h15-3 + c7h15o2h-2 => nc7h16 + c7h15o2-2', [1.440000e+10, 0.0, 15000.0]) + +# Reaction 1163 +reaction('nc7h16 + c7h15o2-3 => c7h15-3 + c7h15o2h-3', [8.064000e+12, 0.0, 17700.05]) + +# Reaction 1164 +reaction('c7h15-3 + c7h15o2h-3 => nc7h16 + c7h15o2-3', [1.440000e+10, 0.0, 15000.0]) + +# Reaction 1165 +reaction('nc7h16 + c7h15o2-1 => c7h15-4 + c7h15o2h-1', [4.032000e+12, 0.0, 17700.05]) + +# Reaction 1166 +reaction('c7h15-4 + c7h15o2h-1 => nc7h16 + c7h15o2-1', [1.440000e+10, 0.0, 15000.0]) + +# Reaction 1167 +reaction('nc7h16 + c7h15o2-2 => c7h15-4 + c7h15o2h-2', [4.032000e+12, 0.0, 17700.05]) + +# Reaction 1168 +reaction('c7h15-4 + c7h15o2h-2 => nc7h16 + c7h15o2-2', [1.440000e+10, 0.0, 15000.0]) + +# Reaction 1169 +reaction('nc7h16 + c7h15o2-3 => c7h15-4 + c7h15o2h-3', [4.032000e+12, 0.0, 17700.05]) + +# Reaction 1170 +reaction('c7h15-4 + c7h15o2h-3 => nc7h16 + c7h15o2-3', [1.440000e+10, 0.0, 15000.0]) + +# Reaction 1171 +reaction('nc7h16 + c7h15-1 => c7h15-2 + nc7h16', [1.000000e+11, 0.0, 10400.1]) + +# Reaction 1172 +reaction('c7h15-2 + nc7h16 => nc7h16 + c7h15-1', [1.500000e+11, 0.0, 12299.95]) + +# Reaction 1173 +reaction('nc7h16 + c7h15-1 => c7h15-3 + nc7h16', [1.000000e+11, 0.0, 10400.1]) + +# Reaction 1174 +reaction('c7h15-3 + nc7h16 => nc7h16 + c7h15-1', [1.500000e+11, 0.0, 12299.95]) + +# Reaction 1175 +reaction('nc7h16 + c7h15-1 => c7h15-4 + nc7h16', [5.000000e+10, 0.0, 10400.1]) + +# Reaction 1176 +reaction('c7h15-4 + nc7h16 => nc7h16 + c7h15-1', [1.500000e+11, 0.0, 12299.95]) + +# Reaction 1177 +reaction('nc7h16 + c7h15-2 => c7h15-3 + nc7h16', [1.000000e+11, 0.0, 10400.1]) + +# Reaction 1178 +reaction('c7h15-3 + nc7h16 => nc7h16 + c7h15-2', [1.000000e+11, 0.0, 10400.1]) + +# Reaction 1179 +reaction('nc7h16 + c7h15-2 => c7h15-4 + nc7h16', [5.000000e+10, 0.0, 10400.1]) + +# Reaction 1180 +reaction('c7h15-4 + nc7h16 => nc7h16 + c7h15-2', [1.000000e+11, 0.0, 10400.1]) + +# Reaction 1181 +reaction('nc7h16 + c7h15-3 => c7h15-4 + nc7h16', [5.000000e+10, 0.0, 10400.1]) + +# Reaction 1182 +reaction('c7h15-4 + nc7h16 => nc7h16 + c7h15-3', [1.000000e+11, 0.0, 10400.1]) + +# Reaction 1183 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[1.000000e+11, 0.0, 7700.05]) + +# Reaction 1195 +reaction('c7h15-3 => c6h12-1 + ch3', [1.027000e+14, -0.42, 28690.01]) + +# Reaction 1196 +reaction('c6h12-1 + ch3 => c7h15-3', [1.750000e+11, 0.0, 7200.05]) + +# Reaction 1197 +reaction('c7h15-3 => c7h14-2 + h', [2.710000e+15, -0.72, 37590.11]) + +# Reaction 1198 +reaction('c7h14-2 + h => c7h15-3', [1.000000e+13, 0.0, 2900.1]) + +# Reaction 1199 +reaction('c7h15-3 => c7h14-3 + h', [2.018000e+15, -0.66, 37679.97]) + +# Reaction 1200 +reaction('c7h14-3 + h => c7h15-3', [1.000000e+13, 0.0, 2900.1]) + +# Reaction 1201 +reaction('c7h15-4 => c2h5 + c5h10-1', [5.426000e+16, -0.89, 30590.11]) + +# Reaction 1202 +reaction('c2h5 + c5h10-1 => c7h15-4', [1.000000e+11, 0.0, 8200.05]) + +# Reaction 1203 +reaction('c7h15-4 => c7h14-3 + h', [4.020000e+15, -0.66, 37679.97]) + +# Reaction 1204 +reaction('c7h14-3 + h => c7h15-4', [1.000000e+13, 0.0, 2900.1]) + +# Reaction 1205 +reaction('c7h15-1 + o2 => c7h14-1 + ho2', [3.000000e-09, 0.0, 3000.0]) + +# 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-0.01, 18179.97]) + +# Reaction 1217 +reaction('c7h15-1 => c7h15-3', [1.386000e+09, 0.98, 33760.04]) + +# Reaction 1218 +reaction('c7h15-3 => c7h15-1', [4.410000e+07, 1.38, 36280.11]) + +# Reaction 1219 +reaction('c7h15-1 => c7h15-4', [2.541000e+09, 0.35, 19760.04]) + +# Reaction 1220 +reaction('c7h15-4 => c7h15-1', [1.611000e+08, 0.74, 22280.11]) + +# Reaction 1221 +reaction('c7h15-2 => c7h15-3', [9.587000e+08, 1.39, 39700.05]) + +# Reaction 1222 +reaction('c7h15-3 => c7h15-2', [9.587000e+08, 1.39, 39700.05]) + +# Reaction 1223 +reaction('c7h15-1 => c7h15-2', [5.478000e+08, 1.62, 38760.04]) + +# Reaction 1224 +reaction('c7h15-2 => c7h15-1', [1.743000e+07, 2.01, 41280.11]) + +# Reaction 1225 +reaction('c7h14-1 + oh => c7h13 + h2o', [3.000000e+13, 0.0, 1229.92]) + +# Reaction 1226 +reaction('c7h13 + h2o => c7h14-1 + oh', [7.917000e+14, -0.46, 36479.92]) + +# Reaction 1227 +reaction('c7h14-2 + oh => c7h13 + h2o', [3.000000e+13, 0.0, 1229.92]) + +# Reaction 1228 +reaction('c7h13 + h2o => 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c7h14o1-3 + oh', [0.000000e+00, 0.0, 0.0]) + +# Reaction 1483 +reaction('c7h14o1-4 + oh => c2h4 + nc3h7coch2 + h2o', [2.500000e+12, 0.0, 0.0]) + +# Reaction 1484 +reaction('c2h4 + nc3h7coch2 + h2o => c7h14o1-4 + oh', [0.000000e+00, 0.0, 0.0]) + +# Reaction 1485 +reaction('c7h14o2-4 + oh => c3h6 + nc3h7co + h2o', [2.500000e+12, 0.0, 0.0]) + +# Reaction 1486 +reaction('c3h6 + nc3h7co + h2o => c7h14o2-4 + oh', [0.000000e+00, 0.0, 0.0]) + +# Reaction 1487 +reaction('c7h14o2-5 + oh => c3h6 + c2h5coch2 + h2o', [2.500000e+12, 0.0, 0.0]) + +# Reaction 1488 +reaction('c3h6 + c2h5coch2 + h2o => c7h14o2-5 + oh', [0.000000e+00, 0.0, 0.0]) + +# Reaction 1489 +reaction('c7h14o3-5 + oh => c2h5cho + c4h7 + h2o', [2.500000e+12, 0.0, 0.0]) + +# Reaction 1490 +reaction('c2h5cho + c4h7 + h2o => c7h14o3-5 + oh', [0.000000e+00, 0.0, 0.0]) + +# Reaction 1491 +reaction('c7h14o1-3 + ho2 => c6h12-1 + hco + h2o2', [5.000000e+12, 0.0, 17700.05]) + +# Reaction 1492 +reaction('c6h12-1 + hco + h2o2 => c7h14o1-3 + ho2', [0.000000e+00, 0.0, 0.0]) + +# Reaction 1493 +reaction('c7h14o1-4 + ho2 => c5h10-1 + ch2cho + h2o2', [5.000000e+12, 0.0, 17700.05]) + +# Reaction 1494 +reaction('c5h10-1 + ch2cho + h2o2 => c7h14o1-4 + ho2', [0.000000e+00, 0.0, 0.0]) + +# Reaction 1495 +reaction('c7h14o2-4 + ho2 => ch3co + c5h10-1 + h2o2', [5.000000e+12, 0.0, 17700.05]) + +# Reaction 1496 +reaction('ch3co + c5h10-1 + h2o2 => c7h14o2-4 + ho2', [0.000000e+00, 0.0, 0.0]) + +# Reaction 1497 +reaction('c7h14o2-5 + ho2 => ch3coch2 + c4h8-1 + h2o2', [5.000000e+12, 0.0, 17700.05]) + +# Reaction 1498 +reaction('ch3coch2 + c4h8-1 + h2o2 => c7h14o2-5 + ho2', [0.000000e+00, 0.0, 0.0]) + +# Reaction 1499 +reaction('c7h14o3-5 + ho2 => c2h5co + c4h8-1 + h2o2', [5.000000e+12, 0.0, 17700.05]) + +# Reaction 1500 +reaction('c2h5co + c4h8-1 + h2o2 => c7h14o3-5 + ho2', [0.000000e+00, 0.0, 0.0]) + +# Reaction 1501 +reaction('c7h14o1-3 + ho2 => c2h4 + nc4h9co + h2o2', [5.000000e+12, 0.0, 17700.05]) + +# Reaction 1502 +reaction('c2h4 + nc4h9co + h2o2 => c7h14o1-3 + ho2', [0.000000e+00, 0.0, 0.0]) + +# Reaction 1503 +reaction('c7h14o1-4 + ho2 => c2h4 + nc3h7coch2 + h2o2', [5.000000e+12, 0.0, 17700.05]) + +# Reaction 1504 +reaction('c2h4 + nc3h7coch2 + h2o2 => c7h14o1-4 + ho2', [0.000000e+00, 0.0, 0.0]) + +# Reaction 1505 +reaction('c7h14o2-4 + ho2 => c3h6 + nc3h7co + h2o2', [5.000000e+12, 0.0, 17700.05]) + +# Reaction 1506 +reaction('c3h6 + nc3h7co + h2o2 => c7h14o2-4 + ho2', [0.000000e+00, 0.0, 0.0]) + +# Reaction 1507 +reaction('c7h14o2-5 + ho2 => c3h6 + c2h5coch2 + h2o2', [5.000000e+12, 0.0, 17700.05]) + +# Reaction 1508 +reaction('c3h6 + c2h5coch2 + h2o2 => c7h14o2-5 + ho2', [0.000000e+00, 0.0, 0.0]) + +# Reaction 1509 +reaction('c7h14o3-5 + ho2 => c2h5cho + c4h7 + h2o2', [5.000000e+12, 0.0, 17700.05]) + +# Reaction 1510 +reaction('c2h5cho + c4h7 + h2o2 => c7h14o3-5 + ho2', [0.000000e+00, 0.0, 0.0]) + +# Reaction 1511 +reaction('nc4h9coch2 => pc4h9 + ch2co', [1.554000e+18, -1.41, 43140.06]) + +# Reaction 1512 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