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__6913779535773696__ initializing
Jmol getValue debug null
Jmol getValue logLevel null
Jmol getValue allowjavascript null
AppletRegistry.checkIn(MoleculeDisplay__6913779535773696__)
vwrOptions:
{ "name":"MoleculeDisplay","applet":true,"documentBase":"https://webbook.nist.gov/cgi/cbook.cgi?Str3View=R527729&Type=JSmol","platform":"J.awtjs.Platform","fullName":"MoleculeDisplay__6913779535773696__","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":"6913779535773696","bgcolor":"black" }
setting document base to "https://webbook.nist.gov/cgi/cbook.cgi?Str3View=R527729&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__6913779535773696__ ready
script 2 started
FileManager.getAtomSetCollectionFromFile(https://webbook.nist.gov/cgi/cbook.cgi?Str3File=R527729)
FileManager opening url https://webbook.nist.gov/cgi/cbook.cgi?Str3File=R527729
The Resolver thinks Mol
NIST 06111522433D 1 1.00000 -1490.98526
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:"2015-06-11"
webbook.id:"R527729"
method:"B3LYP/6-31G*"
dipole.moment:"2.3174 debye"
electronic.energy:"-1490.98526142 hartree"
ir.frequencies:"\"Frequency (cm-1)\" \"Intensity (km/mol)\"\n21.9730 0.3628\n25.3553 0.4109\n27.7942 0.8688\n30.9430 0.4422\n36.4803 2.7596\n45.5247 1.3052\n45.7991 0.3258\n50.8913 0.1326\n59.1378 1.2426\n61.6594 2.1987\n69.7620 0.9991\n70.2475 5.0780\n74.6687 10.2305\n81.3816 0.3438\n85.4916 3.7989\n85.8157 0.3219\n89.9679 0.9445\n102.7496 1.1107\n107.4482 1.0298\n113.7356 1.1508\n115.1307 0.5608\n129.5217 2.3890\n137.4190 0.2934\n157.7635 2.5147\n167.3165 0.5415\n182.3947 3.4844\n198.3663 0.8499\n225.5187 11.5175\n231.6236 0.2073\n235.1056 7.4554\n259.1424 4.4246\n278.2433 10.9261\n296.1429 1.0332\n320.7171 18.4461\n331.8371 0.8199\n352.3815 10.7714\n363.9183 0.8822\n413.0600 11.0543\n425.7190 19.2873\n434.4935 27.0511\n451.8666 5.6349\n485.9394 9.5893\n504.5849 3.0875\n516.2782 7.7734\n555.9848 1.1265\n588.0529 14.1039\n597.6312 4.6585\n599.7377 7.6602\n601.0954 5.0365\n603.7468 4.3011\n615.8780 4.4952\n627.9069 7.4241\n646.4459 18.1506\n654.6085 2.6679\n672.7137 10.9701\n695.2359 5.6570\n714.1030 13.0085\n833.0056 9.1553\n850.2191 28.5316\n871.4419 19.9952\n880.1658 2.6000\n906.2755 5.2846\n939.1295 20.1070\n961.5716 16.9296\n967.5704 41.2224\n983.4501 17.8488\n998.2864 1.9185\n1012.4359 2.5494\n1018.2989 13.8632\n1022.6940 4.9336\n1043.2266 33.8936\n1053.4852 43.3702\n1057.4302 110.8437\n1074.7199 7.6670\n1076.1706 12.5895\n1077.7893 22.1668\n1079.1880 25.1468\n1080.7562 67.6441\n1082.4096 34.0487\n1086.7505 160.5820\n1091.6053 22.6271\n1112.1031 28.0440\n1126.5957 43.0380\n1144.1806 13.7020\n1153.9970 149.4498\n1169.5162 15.4733\n1194.0767 3.1588\n1235.7706 22.4257\n1254.7508 420.7479\n1257.6941 23.9057\n1261.5591 283.8403\n1276.5599 822.2685\n1294.4434 110.3823\n1297.5215 40.4939\n1304.5153 124.5190\n1317.5778 17.2343\n1323.1574 87.8844\n1353.1462 3.4221\n1370.3011 6.9493\n1387.0953 5.7107\n1399.8344 23.3941\n1406.4478 9.1970\n1418.5301 59.7102\n1420.7406 13.6627\n1424.3427 50.6752\n1425.7910 58.3995\n1426.9186 53.6021\n1436.0244 27.9006\n1443.8623 30.1000\n1446.3392 2.0565\n1498.4409 11.0078\n1499.2691 18.5898\n1499.8839 14.9666\n1501.8206 8.7925\n1503.3374 13.0501\n1503.8958 6.0538\n1504.0125 10.4612\n1504.2518 0.8041\n1504.7170 4.8082\n1504.8653 9.0050\n1506.7362 6.0741\n1508.8331 7.0462\n1519.2179 4.3990\n1533.6068 11.1028\n1539.8189 5.6145\n1814.9988 115.6010\n1824.2848 184.6025\n1827.8181 188.3008\n1831.1825 217.6729\n1832.5768 271.8798\n3019.7224 45.4913\n3055.3461 17.0283\n3072.1996 1.5874\n3072.5382 0.9400\n3073.2315 1.5148\n3074.8544 3.0030\n3074.8982 0.2501\n3079.8190 36.5341\n3102.6755 20.1705\n3118.6180 11.9236\n3134.6276 2.1423\n3135.5093 4.9247\n3137.1097 5.1892\n3142.6062 6.3731\n3144.9711 6.9491\n3145.1358 9.8176\n3145.7228 4.9322\n3146.2949 18.3273\n3159.4104 3.8531\n3166.7243 3.2081\n3180.0702 8.2256\n3182.0127 7.2447\n3183.8922 7.8513\n3183.9600 6.2038\n3185.1296 7.0627\n3186.1780 1.5719"
rotational.constants:"0.21394 GHz\n0.14171 GHz\n0.10968 GHz"
software:"Gaussian 09, Revision D.01"
contributor:"Sarah Wollman"
Time for openFile(https://webbook.nist.gov/cgi/cbook.cgi?Str3File=R527729): 55 ms
reading 54 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
54 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