PM7 Accuracy Date:Mon Feb 11 04:20:05 2019

glycerol   1319 Glycerol

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    #  Species Formula
  1309 Boric acid, B(OH)3 (Geo)H3BO3
  1310 TrihydroxyboraneH3BO3
  1311 B2O3B2O3
  1312 Diboron trioxide (Geo)B2O3
  1313 B2O3H2H2B2O3
  1314 B2O3H2 (Geo)H2B2O3
  1315 B3O3H3H3B3O3
  1316 B3O3H3 (Geo)H3B3O3
  1317 1,3,5-TrioxaneC3H6O3
  1318 Methyl hydroxyacetateC3H6O3
  1319 Glycerol C3H8O3
  1320 Trimethoxyborane (Geo)H9BC3O3
  1321 TrimethoxyboraneH9BC3O3
  1322 Maleic anhydrideC4H2O3
  1323 Acetic anhydrideC4H6O3
  1324 TrimethoxymethaneC4H10O3
  1325 2,5,8-TrioxanonaneC6H14O3
  1326 TriethoxyboraneH15BC6O3
  1327 m-Salicylic acidC7H6O3
  1328 o-Salicylic acidC7H6O3
  1329 p-Salicylic acidC7H6O3


ΔHf: -138.1 kcal/mol,     REF: NIST Chemistry WebBook, NIST Standard Reference Database, No. 69; W. G. Mallard, P. J. Linstrom, Eds., National Institute of Standards and Technology, Gaithersberg, http://webbook.nist.gov/chemistry.
  
 PM7
Glycerol
 H=-138.1 HR=NIST
  C    -0.06348070 +1   0.07634460 +1  -0.12466754 +1
  C     1.47393276 +1  -0.01490656 +1  -0.05486964 +1
  C     2.11710548 +1   1.38436368 +1  -0.00682504 +1
  O    -0.54653233 +1   0.67319085 +1   1.06404227 +1
  O     1.83480382 +1  -0.66685042 +1  -1.25706309 +1
  O     1.79593405 +1   2.01262538 +1   1.21187886 +1
  H    -0.52697428 +1  -0.91246404 +1  -0.27944028 +1
  H    -0.40716353 +1   0.76531817 +1  -0.91899484 +1
  H     1.79954030 +1  -0.63347097 +1   0.80934549 +1
  H     1.78356329 +1   2.02171760 +1  -0.84515862 +1
  H     3.22036154 +1   1.33741769 +1  -0.00276899 +1
  H    -0.46454174 +1   0.05872759 +1   1.82305976 +1
  H     2.80380404 +1  -0.79375732 +1  -1.30242226 +1
  H     0.82571536 +1   1.93057648 +1   1.37523567 +1