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

na(plus)(h2o)3r   1692 Na(+)(H2O)3 (Geo)

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    #  Species Formula
  1682 Lithium sodium oxideLiONa
  1683 NaOH.H2OH3O2Na
  1684 NaOH.H2O (Geo)H3O2Na
  1685 Na(+)(H2O)2H4O2Na
  1686 Na(+)(H2O)2 (Geo)H4O2Na
  1687 NaBO2BO2Na
  1688 NaBO2 (Geo)BO2Na
  1689 NaOH.(H2O)2H5O3Na
  1690 NaOH.(H2O)2 (Geo)H5O3Na
  1691 Na(+)(H2O)3H6O3Na
  1692 Na(+)(H2O)3 (Geo) H6O3Na
  1693 Na(+)(H2O)4H8O4Na
  1694 Na(+)(H2O)4 (Geo)H8O4Na
  1695 NaHCO3.(H2O)2CH5O5Na
  1696 NaHCO3.(H2O)2 (Geo)CH5O5Na
  1697 NaNO3.(H2O)2H4NO5Na
  1698 NaNO3.(H2O)2 (Geo)H4NO5Na
  1699 Na(+)(H2O)6H12O6Na
  1700 Na(+)(H2O)6 (Geo)H12O6Na
  1701 Nonactin-sodium thiocyanate (NONACS) (Geo)C40H64O12Na
  1702 Sodium fluoride (NaF) (Geo)FNa


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
Na(+)(H2O)3
 <Na-O> GR=PW91D
 Na     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  O     2.30618700 +1    0.0000000 +0    0.0000000 +0     1     0     0
  O     2.47260736 +1  120.3693945 +1    0.0000000 +0     1     2     0
  O     2.47150378 +1  122.3172865 +1 -179.6103483 +1     1     2     3
  H     0.96365387 +1  127.2465400 +1 -152.0730627 +1     2     1     3
  H     0.96370980 +1  127.2070522 +1 -179.8640629 +1     2     1     5
  H     0.96370827 +1  126.9333652 +1 -141.8001622 +1     3     1     2
  H     0.96369353 +1  127.4193173 +1 -178.1751415 +1     3     1     7
  H     0.96368191 +1  126.9180943 +1 -139.4453529 +1     4     1     2
  H     0.96376524 +1  127.4541053 +1 -178.9659781 +1     4     1     9