loadScript ../packages/jsmol/j2s/core/package.js
loadScript ../packages/jsmol/j2s/core/corejmol.z.js
loadScript ../packages/jsmol/j2s/J/translation/PO.js
loadScript ../packages/jsmol/j2s/core/corescript.z.js
JSmol exec MoleculeDisplay load JSExporter J.export.JSExporter
loadScript ../packages/jsmol/j2s/J/export/JSExporter.js
loadScript ../packages/jsmol/j2s/J/export/___Exporter.js
loadScript ../packages/jsmol/j2s/J/export/Export3D.js
loadScript ../packages/jsmol/j2s/J/export/__CartesianExporter.js
loadScript ../packages/jsmol/j2s/J/g3d/HermiteRenderer.js
loadScript ../packages/jsmol/j2s/J/export/UseTable.js
JSmol exec MoleculeDisplay start applet null
Jmol JavaScript applet MoleculeDisplay__163227343689075__ initializing
Jmol getValue debug null
Jmol getValue logLevel null
Jmol getValue allowjavascript null
AppletRegistry.checkIn(MoleculeDisplay__163227343689075__)
vwrOptions:
{ "name":"MoleculeDisplay","applet":true,"documentBase":"https://webbook.nist.gov/cgi/inchi?Str3View=C99972222&Type=JSmol","platform":"J.awtjs.Platform","fullName":"MoleculeDisplay__163227343689075__","codePath":"https://webbook.nist.gov/cgi/../packages/jsmol/j2s/","signedApplet":"true","appletReadyCallback":"Jmol._readyCallback","statusListener":"[J.appletjs.Jmol object]","script":";set multipleBondSpacing 0.35;","syncId":"163227343689075","bgcolor":"black" }
setting document base to "https://webbook.nist.gov/cgi/inchi?Str3View=C99972222&Type=JSmol"
(C) 2015 Jmol Development
Jmol Version: 14.29.53 2019-08-18 15:32
java.vendor: Java2Script (WebGL)
java.version: 2019-06-08 00:17:46 (JSmol/j2s)
os.name: Mozilla/5.0 AppleWebKit/537.36 (KHTML, like Gecko; compatible; ClaudeBot/1.0; +claudebot@anthropic.com)
Access: ALL
memory: 0.0/0.0
processors available: 1
useCommandThread: false
appletId:MoleculeDisplay (signed)
Jmol getValue emulate null
defaults = "Jmol"
Jmol getValue boxbgcolor null
Jmol getValue bgcolor black
backgroundColor = "black"
Jmol getValue ANIMFRAMECallback null
Jmol getValue APPLETREADYCallback Jmol._readyCallback
APPLETREADYCallback = "Jmol._readyCallback"
StatusManager callback set for APPLETREADYCallback f=Jmol._readyCallback cb=APPLETREADY
Jmol getValue ATOMMOVEDCallback null
Jmol getValue AUDIOCallback null
Jmol getValue CLICKCallback null
Jmol getValue DRAGDROPCallback null
Jmol getValue ECHOCallback null
Jmol getValue ERRORCallback null
Jmol getValue EVALCallback null
Jmol getValue HOVERCallback null
Jmol getValue IMAGECallback null
Jmol getValue LOADSTRUCTCallback null
Jmol getValue MEASURECallback null
Jmol getValue MESSAGECallback null
Jmol getValue MINIMIZATIONCallback null
Jmol getValue SERVICECallback null
Jmol getValue PICKCallback null
Jmol getValue RESIZECallback null
Jmol getValue SCRIPTCallback null
Jmol getValue SYNCCallback null
Jmol getValue STRUCTUREMODIFIEDCallback null
Jmol getValue doTranslate null
language=en_US
Jmol getValue popupMenu null
Jmol getValue script ;set multipleBondSpacing 0.35;
Jmol getValue loadInline null
Jmol getValue load null
script 1 started
multipleBondSpacing = 0.35
Script completed
Jmol script terminated
loadScript ../packages/jsmol/j2s/core/coreprop.z.js
loadScript ../packages/jsmol/j2s/JU/XmlUtil.js
Jmol applet MoleculeDisplay__163227343689075__ ready
script 2 started
FileManager.getAtomSetCollectionFromFile(https://webbook.nist.gov/cgi/inchi?Str3File=C99972222)
FileManager opening url https://webbook.nist.gov/cgi/inchi?Str3File=C99972222
The Resolver thinks Mol
NIST 07091503293D 1 1.00000 -2951.20313
Copyright by the U.S. Sec. Commerce on behalf of U.S.A. All rights reserved.
copyright:"Collection (C) 2016 copyright by the U.S. Secretary of Commerce on behalf of the United States of America. All rights reserved."
date:"2015-07-09"
cas.number:"99972-22-2"
method:"B3LYP/6-31G*"
dipole.moment:"5.4605 debye"
electronic.energy:"-2951.20313185 hartree"
ir.frequencies:"\"Frequency (cm-1)\" \"Intensity (km/mol)\"\n17.1619 1.2572\n21.6263 0.0485\n26.2721 0.6484\n44.0614 1.4388\n59.7696 0.4557\n75.6967 0.3353\n97.6152 2.0334\n119.7983 0.9851\n134.4971 1.7642\n143.3605 1.1306\n172.8332 3.3156\n197.0970 0.0799\n202.8365 0.2443\n222.2023 0.8608\n239.4677 2.5743\n270.2346 3.6272\n276.8402 0.9853\n299.5545 1.6341\n306.9740 3.3793\n335.5876 1.1339\n342.2693 5.2621\n361.2218 4.6266\n419.1787 3.3928\n454.1227 2.5992\n462.7996 0.6367\n493.1211 12.4587\n534.5321 12.8706\n568.7801 3.5698\n593.8907 1.6349\n626.2318 34.6307\n671.2173 39.0207\n678.1505 62.7313\n687.9585 1.4020\n717.3900 16.4138\n743.9297 49.4392\n784.2311 32.4224\n811.8753 18.7982\n842.8547 41.1096\n856.7786 1.5493\n877.9377 23.2513\n934.1817 8.6503\n942.8049 27.7183\n960.2035 65.4876\n1007.4069 86.0146\n1038.9243 23.1115\n1069.0317 20.3400\n1097.6811 4.0669\n1105.8229 77.7598\n1138.4181 30.8774\n1149.2750 119.3939\n1186.6008 2.6651\n1214.0803 372.6370\n1265.3040 62.2590\n1269.9968 21.8026\n1281.9581 129.2306\n1308.2469 106.2754\n1319.2337 29.5794\n1335.8380 57.0853\n1341.0592 25.9350\n1415.7977 18.9913\n1441.3813 18.3953\n1450.9147 14.3974\n1502.1358 7.3406\n1512.8149 225.5518\n1531.9156 1.8277\n1533.8196 4.7649\n1618.9116 32.9512\n1650.8194 102.2827\n1860.8380 253.4743\n3028.0100 27.0098\n3082.7746 12.4116\n3086.8200 31.0437\n3141.6903 6.9465\n3176.3701 11.7731\n3211.9800 2.9067\n3221.6823 3.5426\n3238.7767 4.0526\n3239.2614 1.8986"
rotational.constants:"0.50667 GHz\n0.09887 GHz\n0.08916 GHz"
software:"Gaussian 09, Revision D.01"
contributor:"Avi Newman"
Time for openFile(https://webbook.nist.gov/cgi/inchi?Str3File=C99972222): 195 ms
reading 28 atoms
ModelSet: haveSymmetry:false haveUnitcells:false haveFractionalCoord:false
1 model in this collection. Use getProperty "modelInfo" or getProperty "auxiliaryInfo" to inspect them.
Default Van der Waals type for model set to Babel
28 atoms created
ModelSet: not autobonding; use forceAutobond=true to force automatic bond creation
Time for creating model: 8 ms
Script completed
Jmol script terminated
__Exporter exportScale: 10
__Exporter exportScale: 10