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

lino3.2h2or   1435 LiNO3.2H2O (Geo)

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    #  Species Formula
  1425 N,N'-Bis(o-methoxyphenyl) terephthalamideC22H20N2O4
  1426 N,N'-Bis(p-methoxyphenyl) terephthalamideC22H20N2O4
  1427 MethyldinitramineCH3N3O4
  1428 LiHCO3.2H2OH5LiCO5
  1429 LiHCO3.2H2O (Geo)H5LiCO5
  1430 Tartronic acidC3H4O5
  1431 1,3,5,7,9-pentaoxecaneC5H10O5
  1432 3,5,7,9,11-Pentaoxa-tridecaneC8H18O5
  1433 15-Crown-5C10H20O5
  1434 LiNO3.2H2OH4LiNO5
  1435 LiNO3.2H2O (Geo) H4LiNO5
  1436 Dinitrogen pentoxideN2O5
  1437 SER-SERC6H12N2O5
  1438 THR-THRC8H16N2O5
  1439 Li(+)(H2O)5.OHH11LiO6
  1440 Li(+)(H2O)5.OH (Geo)H11LiO6
  1441 Li(+)(H2O)6H12LiO6
  1442 Li(+)(H2O)6 (Geo)H12LiO6
  1443 B3O3(OH)3H3B3O6
  1444 Tri-acetyl borate (Geo)H9BC6O6
  1445 Tri-acetyl borateH9BC6O6


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.
  
 PM7
LiNO3.2H2O
 <Li-O> <O-N> <N-O-Li> GR=PW91D
 Li     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  O     2.05856400 +1    0.0000000 +0    0.0000000 +0     1     0     0
  N     1.30865400 +1   88.6643390 +1    0.0000000 +0     2     1     0
  O     1.26745331 +1  113.7919563 +1    2.2026238 +1     3     2     1
  O     2.32226127 +1   73.5932483 +1  145.4484369 +1     1     2     3
  H     2.72059892 +1   87.6024125 +1  178.6267695 +1     1     2     5
  H     1.52811497 +1  148.1830666 +1 -154.1283412 +1     6     1     2
  O     1.20252290 +1  122.9419246 +1 -179.9022936 +1     3     2     4
  H     0.95434466 +1  147.6154171 +1  134.3503980 +1     5     1     2
  H     0.97275181 +1  101.0357145 +1 -144.3891455 +1     5     1     9
  O     0.95166725 +1   37.2745800 +1   25.3258892 +1     7     6     1