 H Mo  S 
 1.0000000000000000
    12.3987999999999996    0.0000000000000000    0.0000000000000000
     0.0000000000000000   12.7219999999999995    0.0000000000000000
     0.0000000000000000    0.0000000000000000   20.5799999999999983
 H   Mo  S  
   4  24  44
Cartesian
  8.2557521503654314  0.0748891041365156 11.5464978237861988
  8.2569997194477640  6.2823420247751480 11.5468592179293346
 10.4600749523247689  3.1781000127273438 11.5763028846943659
  9.6953511509593060  9.5405849456728369 13.9292469028276891
  3.1138998196080956  6.3236419059499163 12.3954018831218011
  9.2932751137701768  3.1788695434860563  8.5884783114062770
  9.2743064252481364  4.8161243857055833  6.0810577041285381
  3.1162450342149253  1.5987300107584577  9.7843597122345241
  9.3533521580275654  4.7067512796397413 11.3512042356764162
  3.1139822303442291  3.1815417246276909 12.4252534602765508
  3.1505564425497781 -0.0024750594072209  6.9867606426885693
  9.3306502291329441 -0.0128548810561071  8.6568047657566183
  9.2750022416804612  1.5412533427149673  6.0809238375476715
  3.1160463549027644  4.7643896180706804  9.7844629893625310
  3.0774742253697993  3.1820572215713363  6.9688901447274230
  9.3527848658339359  1.6496475327541655 11.3508370947907107
  3.1139708563646145 11.1358394223340493  9.8375515194917060
  3.1144331890326757  0.0391403925147629 12.3949348698763231
  9.2913503213200919  9.5399339668003371  8.7855811934296426
  9.3583070843815932  7.7400595811430222 11.3882016258254577
  3.1138029764956445  7.9490542088032878  9.8375319339717695
  9.3570157318336875 11.3391588753435624 11.3872046412080685
  9.2851729395527922 11.1041527201245529  6.1476398092867992
  3.1044330475715749  9.5426366714148916 12.3630520715178758
  3.1513017891932744  6.3665939654007451  6.9860751417052773
  9.3304701574514901  6.3704232431922971  8.6576274537924789
  9.2843862691181833  7.9750019038588569  6.1483848091376894
  3.0871694355760311  9.5429062558321061  7.0057077363119680
  7.7716377273202495  1.5859282380340289  9.5819503860469268
  8.0587638853889061  3.1777961623503823 12.5726612913579121
 10.8843955347470231  1.6253001659066142  9.5463467570546090
  1.5643504101235954  3.1816233869536923  8.8359977777979140
  4.6578593176946921  3.1815935307665333  8.8100863630339141
  1.5209919089414863  1.6165765803114780 11.6131548393330490
  4.7108105298956024  1.6185823877168137 11.6174987149823838
  1.5205468502781989  4.7458908292643303 11.6128819709248692
  8.7373608034371646  9.5399540490653667 12.9667422511677746
  4.6288596528399344  4.7875807139568769  6.0192502483858696
  7.6717602938027989 -0.0237646288613931  6.8595371684745237
  7.6681159078893026  3.1785518629375904  6.7551884965974800
  4.7103224300732878  4.7442954805939248 11.6174435926088098
 10.5765031227962591  0.1678314743189013 12.6724747187158844
  7.7721062293821124  4.7712629734010115  9.5831416277402806
 10.8923283450074582  3.1793539236450434  6.7232801966349474
  4.6626440237799871 -0.0091988081877084  8.8661189626594723
  1.5780845220011659 -0.0063799257286288  8.8406073136186887
 10.8848193401512283  4.7322551969953599  9.5465088447039719
 10.9194775607675023 -0.0174008479388252  6.7990981311180381
  4.6341301992339039 11.1314558911799395  6.0361877142442424
  7.6858517496047742  9.5398394410131093  6.9479856587546474
  1.5958121288535121  7.9665488296815701  6.0474635519627435
  4.6283522233814427  1.5754723131048294  6.0195111841026350
  1.5787642885460049  6.3698901267754140  8.8403240334321485
  4.6623317611210986  6.3721103613564871  8.8665344126923582
 10.8922179782829609  9.5398669174568820  6.9160278963994850
  7.7305055575781330 11.1563085267365132  9.7075173074969339
 10.5765943102416884  6.1891820839600102 12.6733822524111748
  4.7344040823311397 11.1579356910415086 11.6901409386178265
  1.5938227018403013  1.5941225902072997  6.0279568146208158
  7.6711932137159637  6.3817218502847011  6.8608866752358528
 10.8920097930231119 11.1460201655892046  9.6867730835676813
 10.9191000951442145  6.3743270418267084  6.7994869965715017
  4.6348090211332558  7.9537471790641909  6.0366594066055157
  7.7309301140280002  7.9238569272433645  9.7085669223621682
 10.8923856574705393  7.9341650800195538  9.6868759041600150
  1.5667410061498193  9.5425803439045094  8.8870926251023779
  4.6522924436013575  9.5423912808455107  8.8695605644077773
  1.4873596726664549  7.9188192739887109 11.6806194721070078
  4.7340908926098653  7.9267987822386452 11.6902663641046836
  1.4877355556931016 11.1665308889137425 11.6810422424133158
  1.5961409076800215 11.1200448538391665  6.0468789906398417
  1.5960828871561310  4.7708623692928001  6.0253078849697657
