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__0083145469850057__ initializing
Jmol getValue debug null
Jmol getValue logLevel null
Jmol getValue allowjavascript null
AppletRegistry.checkIn(MoleculeDisplay__0083145469850057__)
vwrOptions:
{ "name":"MoleculeDisplay","applet":true,"documentBase":"https://webbook.nist.gov/cgi/cbook.cgi?Str3View=C886599&Type=JSmol","platform":"J.awtjs.Platform","fullName":"MoleculeDisplay__0083145469850057__","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":"0083145469850057","bgcolor":"black" }
setting document base to "https://webbook.nist.gov/cgi/cbook.cgi?Str3View=C886599&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__0083145469850057__ ready
script 2 started
FileManager.getAtomSetCollectionFromFile(https://webbook.nist.gov/cgi/cbook.cgi?Str3File=C886599)
FileManager opening url https://webbook.nist.gov/cgi/cbook.cgi?Str3File=C886599
The Resolver thinks Mol
NIST 08031402213D 1 1.00000 -690.98419
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:"2014-08-03"
cas.number:"886-59-9"
method:"B3LYP/6-31G*"
dipole.moment:"3.2386 debye"
electronic.energy:"-690.984188432 hartree"
ir.frequencies:"\"Frequency (cm-1)\" \"Intensity (km/mol)\"\n18.1045 0.0224\n32.6365 0.7247\n48.0838 0.0587\n83.8336 2.5770\n99.9825 1.1304\n134.2294 0.6264\n186.0647 0.4712\n232.4457 0.0223\n252.7371 5.5207\n300.1984 1.0282\n320.7677 2.5079\n353.3058 0.7141\n398.8002 2.3834\n419.3219 0.6886\n420.8667 2.3719\n451.6162 1.2772\n471.6752 1.5471\n511.6503 26.2677\n513.9716 5.5743\n561.9668 43.5626\n610.4685 36.4886\n635.4986 7.2245\n676.8525 47.7720\n707.5996 16.6422\n728.8221 20.3542\n766.9009 51.8285\n789.0255 69.4267\n802.3287 1.0575\n819.9299 3.8243\n847.9491 0.1633\n858.5504 1.7228\n874.5329 1.2605\n905.9880 9.8329\n910.6193 3.0180\n919.2425 2.9613\n940.2100 0.1345\n963.5522 4.9384\n966.1870 2.7446\n989.6876 1.4306\n1014.6368 3.4067\n1018.7197 8.8556\n1045.0408 1.4041\n1059.6624 3.8718\n1072.0073 1.7340\n1100.0093 0.2718\n1109.5163 2.7293\n1115.7393 2.8335\n1132.6073 34.2723\n1183.1333 30.0902\n1192.0123 0.6986\n1212.5785 4.5666\n1222.1747 1.9276\n1270.1889 37.4263\n1282.1003 34.6436\n1301.4464 2.9861\n1301.7387 4.8776\n1344.2233 87.8010\n1349.1302 3.5758\n1358.6101 12.9526\n1365.7217 21.8142\n1385.4976 3.8322\n1391.1449 1.2719\n1396.0940 200.7809\n1399.7487 22.1360\n1413.6339 171.4646\n1417.1066 97.2639\n1463.0829 0.6970\n1491.0634 3.6000\n1511.4162 0.8133\n1517.2618 0.1061\n1519.1856 3.8232\n1522.6109 10.6992\n1525.1939 14.7869\n1537.3678 3.6993\n1547.8759 85.6413\n1644.5673 8.1481\n1664.3296 60.7342\n1797.8310 557.6579\n3011.3417 18.6552\n3022.1633 17.3916\n3022.9506 15.0034\n3028.4044 10.0810\n3031.8629 46.9438\n3074.6792 73.2861\n3075.5620 57.9029\n3079.0803 0.5786\n3080.7230 61.2925\n3081.5280 21.8005\n3103.1203 37.9030\n3180.0344 7.2363\n3187.8983 1.4965\n3197.3786 27.4140\n3211.9201 23.7935\n3227.6630 2.0656\n3550.5385 15.7725\n3590.3710 34.7375"
rotational.constants:"0.70621 GHz\n0.35499 GHz\n0.28708 GHz"
software:"Gaussian 09, Revision D.01"
contributor:"Ethan Ho"
Time for openFile(https://webbook.nist.gov/cgi/cbook.cgi?Str3File=C886599): 129 ms
reading 34 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
34 atoms created
ModelSet: not autobonding; use forceAutobond=true to force automatic bond creation
Time for creating model: 7 ms
Script completed
Jmol script terminated
__Exporter exportScale: 10
__Exporter exportScale: 10