63
TIP5P (H2O)21 energy -935.3950 kJ/mol
O    -0.4340638099000000     2.6793325750000001    -0.4509452361000000
H    -1.2953031734606260     2.9065708741811944    -0.1004293961741466
H    -0.3478003325266137     1.7404607039456614    -0.2856876728407736
O    -1.6998329610000000     1.5357664559999999     3.0360627820000001
H    -1.7127986356679883     0.5859226425146914     2.9183323217779731
H    -0.7739222325682273     1.7510821985609282     3.1481354993775179
O    -3.7168143020000000     0.4965078010000000    -0.7389884699000000
H    -3.4257729992981094     1.2208209578838805    -0.1850053917410237
H    -3.2497257295085835     0.6232962436149934    -1.5648121776410626
O     1.7479149430000001    -1.3383827399999999    -3.0402338179999999
H     2.1808176327148976    -1.8175521725259642    -2.3336761372899586
H     0.8131804649030130    -1.4721886067270673    -2.8833922243898482
O    -0.7531110743000000    -1.2759740920000000    -2.0771242619999999
H    -0.5499922265348626    -0.7519406217789762    -1.3022929927738061
H    -1.3852588917337960    -0.7480698189088247    -2.5649132075141088
O    -2.7967104059999999     2.5175687720000002     0.8449509897000000
H    -3.4198920596007563     3.1939651078417319     1.1102139978170509
H    -2.4542774948357358     2.1704184513587430     1.6686367284561356
O     1.7588770780000000     3.2262975830000000     1.0032229100000001
H     2.4063274428444283     2.8140188607795613     0.4313259610073518
H     0.9737023997822323     3.3024816563345971     0.4610711308313118
O    -1.4453455330000000    -0.9782384157000000     2.0973375380000001
H    -0.9615441897369220    -1.6867791148653093     2.5217644196688886
H    -2.2171656466984326    -1.4043385657738527     1.7245584959421354
O    -1.4971800129999999    -3.4627428889999998    -0.6794224700000000
H    -2.2237656079085015    -3.0333359067084684    -0.2278531432840027
H    -1.2538837639252676    -2.8532481413185620    -1.3762401848543995
O     2.1420957899999999     1.2616460169999999    -3.1909884989999999
H     2.6085685613167220     1.3591892881738705    -4.0211212015655589
H     1.9954780848644835     0.3194451496588668    -3.1073666470567911
O    -2.2712224650000001     0.7157833685000000    -3.0583343620000001
H    -2.7484165285841251     0.7602846564120124    -3.8869098269120639
H    -1.6108290648014656     1.4055297760516425    -3.1243819981713470
O    -0.2974577900000000     2.4777642879999999    -3.1159600950000002
H     0.5712424309821273     2.0895823994760265    -3.2203947036676475
H    -0.3025264993596524     2.8174377370271735    -2.2210701038773975
O     3.2959181680000000     1.8995366359999999    -0.8359101126000000
H     4.1692363989122718     2.2202991432296870    -1.0609845925216148
H     2.8549725829023402     1.7925189060281532    -1.6787303997636138
O     2.4528032149999999    -0.2694364292000000     0.5441475115000000
H     2.7399825336858150    -1.0557474690404116     0.0799548494034925
H     2.9529605811036368     0.4417382961994599     0.1437664941112178
O    -0.1233434666000000     0.1118124207000000     0.0842196541000000
H     0.7981385183397374    -0.0324642408322961     0.2993638763524636
H    -0.6019018605109797    -0.2190796572221446     0.8443013183872723
O     0.4423057276000000    -2.6732388149999999     2.9937799030000001
H     1.0770665585878487    -1.9669038457893557     3.1137858974911663
H     0.5203802780000950    -3.2033798595421659     3.7869297485346034
O    -3.3885394610000001    -1.8532073720000000     0.4552852405000000
H    -3.4931984463827224    -1.0395672961460041    -0.0379369850160073
H    -4.2830521187670785    -2.1564552720916614     0.6105902828665506
O     2.6950939990000000    -2.5730433499999998    -0.8161101296000000
H     1.9938513362021677    -3.0458424587544579    -0.3678339082440198
H     3.4147330243689522    -3.2021893331709244    -0.8663778630471709
O     2.0466314149999998    -0.5779359009000000     3.1809824529999999
H     1.6099898224558977     0.2558043687626058     3.3554906831883673
H     2.4017969679571802    -0.4824836349315374     2.2972527800150386
O     0.8582934738000000    -3.8579086550000001     0.5741239559000000
H    -0.0046512987504881    -3.8527649782517939     0.1599600968812581
H     0.7079057476510170    -3.4941272125871046     1.4466366686897518
O     0.9836874544000000     1.9380927219999999     3.1899045159999999
H     1.2748438096779047     2.5179204708028937     3.8936513444116496
H     1.2940178404357348     2.3590923963858925     2.3882274203624325
