      69
 i =      195, E =      -582.6245157278
  O        23.8358009816       21.4126744616       17.3008469944
  O        24.0374074788       18.5170933456       17.2382246272
  O        17.8383239224       17.7683320937       17.3140338885
  O        18.0471504045       24.9827636373       17.4415409266
  O        18.0459088492       21.7497082646       17.2515648502
  O        19.5245728983       16.2322692513       19.2597121223
  O        19.8106892782       23.4423409149       19.3291961474
  O        25.2527901764       19.9435985420       19.5412653812
  O        21.4119093104       19.8596138110       17.8436072054
  O        15.4859469713       15.9606014720       18.0499711907
  O        17.1680621191       14.5474471997       20.0675158569
  O        17.0336299705       17.6444302124       20.0767369826
  O        17.9203357396       14.7498575307       17.1762456436
  O        15.9615690701       22.8929724084       18.1124398051
  O        17.3804440187       21.7490857646       20.2073379192
  O        17.1717222640       24.6519442050       20.4045948577
  O        22.6933999561       18.4600156639       20.1251104991
  O        22.7627084407       21.4891282723       20.0062544961
  O        21.3404883719       25.3173960070       20.4750498459
 Mg        17.5080216997       16.1611899114       18.7195364361
 Mg        17.7776012291       23.3673011703       18.8547553325
 Mg        23.3006172985       19.8652669506       18.7207058407
  H        23.4964723624       17.7969560843       16.8644512217
  H        24.0204889892       22.3437413559       17.5209188823
  H        24.3429394890       21.2342332352       16.4860303644
  H        24.9581111335       18.2976047880       17.0005202238
  H        17.9820045353       17.6926922374       16.3533592615
  H        18.7831778769       25.5990669145       17.2783938337
  H        18.2361951013       22.0835414456       16.3551833007
  H        21.1201317416       20.3789328669       17.0748158313
  H        19.9084032468       15.6064089530       19.9018124789
  H        20.4734593934       22.8764092373       18.8995538284
  H        25.4731287027       20.6354825391       20.2150219512
  H        20.6166504254       19.6779430847       18.4294527665
  H        17.7734553954       18.7226928175       17.5177328854
  H        17.2698522777       25.3838930923       17.0081382290
  H        17.0330496052       21.9491919902       17.3741857458
  H        19.7873062010       17.1484148828       19.5678848501
  H        20.3257566758       24.1850593549       19.7754168575
  H        26.0011419682       19.3208632241       19.5236853217
  H        15.0037246611       16.5481535533       17.4376540350
  H        14.8124392384       15.3580375999       18.4214998046
  H        16.9191667248       14.6111247902       21.0099051494
  H        17.1954455638       13.5920606106       19.8654080224
  H        16.1790121585       17.9814407355       20.4003337303
  H        17.7398183912       18.3019247484       20.3250631659
  H        17.2476834127       14.3156686328       16.6170409331
  H        18.7758788074       14.3504276224       16.9299090266
  H        15.4005810812       23.3402468865       17.4573499340
  H        15.1196553264       22.9516678796       19.5183191170
  H        16.4871559056       21.9546350427       20.6078233759
  H        17.9815394564       21.5339028267       20.9415142619
  H        16.2756752756       24.3100239283       20.6980014909
  H        17.1162953961       25.6238941382       20.4205572193
  H        21.7263737208       18.4974395155       20.3344795252
  H        23.1546767275       18.3804540094       21.0147627803
  H        21.9890031622       21.3320856618       20.5807305801
  H        23.4709465946       21.8603103575       20.5989815192
  H        21.5853847534       26.1574580173       20.0437080232
  H        21.1920294816       25.5564441481       21.4094159451
  O        23.8488685054       18.4504180247       22.5578055230
  H        23.2882051803       18.4200754543       23.3554741496
  H        24.5849961818       17.8423545608       22.7619464121
  O        25.1194807216       22.0793957914       21.3443029743
  H        25.2303986886       21.8550713427       22.2897327865
  H        25.6486406827       22.8928516114       21.2224376592
  O        15.0859796763       23.0261397456       20.5382473888
  H        14.1605140955       23.0117903751       20.8408865077
 Cl        19.6857800552       19.1577415315       20.1625784339
