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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__2568286031052804__ initializing
Jmol getValue debug null
Jmol getValue logLevel null
Jmol getValue allowjavascript null
AppletRegistry.checkIn(MoleculeDisplay__2568286031052804__)
vwrOptions:
{ "name":"MoleculeDisplay","applet":true,"documentBase":"https://webbook.nist.gov/cgi/inchi?Str3View=C18825031&Type=JSmol","platform":"J.awtjs.Platform","fullName":"MoleculeDisplay__2568286031052804__","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":"2568286031052804","bgcolor":"black" }
setting document base to "https://webbook.nist.gov/cgi/inchi?Str3View=C18825031&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__2568286031052804__ ready
script 2 started
FileManager.getAtomSetCollectionFromFile(https://webbook.nist.gov/cgi/inchi?Str3File=C18825031)
FileManager opening url https://webbook.nist.gov/cgi/inchi?Str3File=C18825031
The Resolver thinks Mol
NIST 07101501493D 1 1.00000 -1891.76138
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:"2015-07-10"
cas.number:"18825-03-1"
method:"B3LYP/6-31G*"
dipole.moment:"2.6172 debye"
electronic.energy:"-1891.76138349 hartree"
ir.frequencies:"\"Frequency (cm-1)\" \"Intensity (km/mol)\"\n4.3441 0.5994\n40.3483 0.3904\n44.7956 1.3728\n54.3534 0.1408\n60.7833 0.1079\n65.9438 0.0742\n68.3810 0.2615\n99.7652 0.1279\n104.8766 0.8331\n123.9673 0.4793\n136.8870 0.6275\n143.4351 0.3638\n160.9535 1.5790\n165.0947 1.3041\n172.8151 6.0153\n219.6282 1.5502\n228.5159 3.2578\n240.4945 0.3981\n258.4416 1.1608\n272.5332 4.9640\n278.0326 12.0367\n307.0989 5.5336\n314.9424 6.7642\n387.3032 10.6157\n396.3549 20.7413\n440.2330 8.2334\n499.8858 102.4227\n569.0443 73.3843\n638.9404 71.1236\n653.9508 9.4203\n686.2179 48.0942\n695.0288 24.0957\n722.5184 88.9340\n740.4267 76.8555\n747.7476 125.0559\n776.0482 4.8571\n978.3671 8.6505\n979.1956 7.6600\n985.3385 13.1557\n986.4178 3.7715\n992.7553 5.1848\n993.3684 2.2057\n999.6063 24.5029\n1009.4610 3.5162\n1037.3193 19.4573\n1039.6806 18.2619\n1053.5595 33.7891\n1053.8178 34.4245\n1085.7233 783.5904\n1274.3178 0.7974\n1275.4878 1.7605\n1280.8252 6.7377\n1281.9334 0.4995\n1295.0397 4.9370\n1296.2606 5.6416\n1301.5861 7.8648\n1301.9749 7.9210\n1439.1098 0.1779\n1442.7098 0.5927\n1444.4400 1.3206\n1445.4037 0.6150\n1479.0108 3.3816\n1480.3337 9.5623\n1481.6825 4.1740\n1483.3399 8.8386\n1530.8139 0.8824\n1531.9427 4.1729\n1532.5078 5.6896\n1535.5649 1.7749\n1536.3986 5.4780\n1537.2411 5.5535\n1539.0883 4.9660\n1539.6350 3.8086\n3023.8696 12.8449\n3026.2751 12.3710\n3041.4985 7.6188\n3042.0008 7.7493\n3048.1843 32.2411\n3048.4968 31.9109\n3051.6061 35.8970\n3054.0056 34.0017\n3062.0437 14.0625\n3065.9694 10.9128\n3079.1147 5.1410\n3083.2355 4.4900\n3108.9555 29.3571\n3109.9142 30.7840\n3113.1202 40.8111\n3115.8399 23.8564\n3118.6714 40.2965\n3123.7123 30.7010\n3126.6297 25.4791\n3135.0278 16.5519"
rotational.constants:"0.51270 GHz\n0.33587 GHz\n0.32518 GHz"
software:"Gaussian 09, Revision D.01"
contributor:"Ashley Zhang"
Time for openFile(https://webbook.nist.gov/cgi/inchi?Str3File=C18825031): 307 ms
reading 33 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
33 atoms created
ModelSet: not autobonding; use forceAutobond=true to force automatic bond creation
Time for creating model: 9 ms
Script completed
Jmol script terminated
__Exporter exportScale: 10
__Exporter exportScale: 10