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

k(plus)(h2o)5.cl   2715 K(+)(H2O)5.Cl

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    #  Species Formula
  2705 KHSO4 (corrected for PW91D error in H2SO4)HO4SK
  2706 K(I)O5N3 (POZTCK) (Geo)C17H32N3O5SK
  2707 K(I)O5N3 (POZTCK)C17H32N3O5SK
  2708 KHSO4.2H2O (corrected for PW91D error in H2SO4)H5O6SK
  2709 KHSO4.2H2O (Geo)H5O6SK
  2710 K(I)O6S (RUXVAH) (Geo)C16H33O6SK
  2711 K(I)O6S (RUXVAH)C16H33O6SK
  2712 Potassium chloride (Geo)ClK
  2713 Potassium chlorideClK
  2714 K(+)(H2O)5.Cl (Geo)H10O5ClK
  2715 K(+)(H2O)5.Cl H10O5ClK
  2716 Argon potassium cation (Geo)ArK
  2717 Potassium, dimer (Geo)K2
  2718 Potassium, dimerK2
  2719 K2O (Geo)OK2
  2720 Potassium fluoride, dimer (Geo)F2K2
  2721 Potassium fluoride, dimerF2K2
  2722 Potassium sulfide (Geo)SK2
  2723 Potassium sulfideSK2
  2724 Potassium sulfateO4SK2
  2725 Potassium chloride, dimer (Geo)Cl2K2


ΔHf: -361.9 kcal/mol,     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
K(+)(H2O)5.Cl
 H=-361.9 HR=PW91D
  K     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  O     4.40883588 +1    0.0000000 +0    0.0000000 +0     1     0     0
  O     4.35996661 +1   35.7362374 +1    0.0000000 +0     1     2     0
  O     4.40988558 +1   79.4680031 +1  106.4121433 +1     1     2     3
 Cl     3.01628673 +1   41.0540884 +1  -27.9896840 +1     4     1     2
  O     2.86260530 +1  109.3951466 +1   19.7389763 +1     1     2     4
  O     2.83118054 +1   36.4369208 +1  169.7384959 +1     1     2     6
  H     0.95253734 +1  156.5083475 +1 -153.2880042 +1     2     1     3
  H     0.98082242 +1   56.1507279 +1   46.9324986 +1     2     1     8
  H     0.97142281 +1   88.3378840 +1    4.4704691 +1     3     1     2
  H     0.96589951 +1   65.6796987 +1  105.7523002 +1     3     1    10
  H     0.97686367 +1   67.6821338 +1   39.0399864 +1     4     1     5
  H     0.96699187 +1   85.0038391 +1  -66.4029973 +1     4     1     5
  H     0.99322994 +1  108.8412700 +1  -36.5588109 +1     6     1     2
  H     0.94745414 +1  138.7802579 +1  144.4219830 +1     6     1    14
  H     0.96764233 +1  113.7609117 +1  -31.3755995 +1     7     1     2
  H     0.99065569 +1  107.7376242 +1  110.1625260 +1     7     1    16