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

b(oh)4, anion r   1372 B(OH)4, anion (Geo)

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    #  Species Formula
  1362 ILE-ILEC12H24N2O3
  1363 LEU-LEUC12H24N2O3
  1364 Naphthoquinone dye (Torsion angle) (Geo)C21H20N2O3
  1365 1,3,5-Triazine-2,4,6(1H,3H,5H)-trioneC3H3N3O3
  1366 1,3,5-Trimethyl-s-triazine-2,4,6-trioneC6H9N3O3
  1367 2,4,6-Trimethoxy-s-triazineC6H9N3O3
  1368 Li(+)(H2O)4H8LiO4
  1369 Li(+)(H2O)4 (Geo)H8LiO4
  1370 Li(I)(H2O)4(+) (BADTUV10) (Geo)H8LiO4
  1371 Li(I)(H2O)4(+) (BADTUV10)H8LiO4
  1372 B(OH)4, anion (Geo) H4BO4
  1373 TetrahydroxydiboraneH4B2O4
  1374 Oxalic acidC2H2O4
  1375 Formic acid, dimer (Geo)C2H4O4
  1376 Formic acid, dimerC2H4O4
  1377 DioxybismethanolC2H6O4
  1378 (C2H4)BO4H2, anion (Geo)H6BC2O4
  1379 1,4-Dioxan-2,5-dioneC4H4O4
  1380 Dimethyl oxalateC4H6O4
  1381 1,3,5,7-TetroxaneC4H8O4
  1382 Dimethyl malonateC5H8O4


REF: Estimated from DGauss results of DFT calculations, using the B88-PW91 functional and the DZVP basis set, in CAChe 6.0, Fujitsu Ltd, 2003.
  
 CHARGE=-1 PM7
B(OH)4, anion
 <B-O> <><> <><><> <><><> <O-H><B-O-H> GR=PW91D
  B     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  O     1.50702400 +1    0.0000000 +0    0.0000000 +0     1     0     0
  O     1.50224134 +1  109.3195169 +1    0.0000000 +0     1     2     0
  O     1.50665558 +1  109.5308295 +1  119.8537116 +1     1     2     3
  O     1.50648926 +1  109.6013511 +1  120.2548823 +1     1     2     4
  H     0.97541600 +1  103.6624270 +1    0.1253578 +1     2     1     3
  H     0.95023706 +1  107.3073537 +1 -179.8667269 +1     3     1     2
  H     0.94851644 +1  107.7811901 +1   13.9326278 +1     4     1     2
  H     0.94856949 +1  107.7603887 +1  -14.7510027 +1     5     1     2