ClustersTIP3Pn6.xyz

From SklogWiki
Jump to navigation Jump to search
18

Energy of minimum 0= -199.9530523652

 O      -1.1114448151      0.9120705049      3.2629915614
 H      -1.4065837885      1.4873685056      2.5571891560
 H      -1.8679775703      0.8384060838      3.8447677918
 O      -2.8492703855      2.9461673381     -1.2774033281
 H      -1.9971207232      2.7497085271     -1.6666034404
 H      -3.4058832155      3.1754468790     -2.0216108855
 O      -0.3322875719      2.3998193431     -2.1453415677
 H       0.1404575138      2.4949458012     -1.3184831277
 H       0.2767869785      1.9332940611     -2.7177174863
 O       1.3596225937      0.7488169726      2.1554095068
 H       1.8123291313      0.0043862342      2.5517824440
 H       0.5119300006      0.7780953089      2.5990218212
 O      -1.7194728581      2.5328489628      1.1953140053
 H      -0.8468003405      2.6847646517      0.8325521835
 H      -2.3143916928      2.6846622516      0.4609733865
 O       0.9558297908      2.6327393535      0.2587240116
 H       1.5559952785      3.3229098194      0.5410322724
 H       1.1353895710      1.9018413285      0.8501445060