Ba Ti  O  H 
 1.0000000000000000
    11.9729322047481066    0.0000000000000000    0.0025297367636978
     0.0000000000000000   11.9406099564592374    0.0000000000000000
     0.0025267469069965    0.0000000000000000   12.0075830425609293
 Ba  Ti  O   H  
  27  27  79   1
Cartesian
 11.9577684190061024 -0.0000000581230563 12.0084461705290781
 11.9590985093141136 -0.0000000311582300  4.0023205598581981
 11.9570834591869062  0.0000000323866155  8.0115978259603580
  3.9666123641511177 -0.0000000491269865 11.9989776526158280
  7.9749525768992440 -0.0000000559103574  0.0185263609397008
 11.9592165993387098  3.9504045185618599  0.0315986042551079
 11.9592165721581534  7.9902054358112666  0.0315986563824722
 11.9567345362046673  3.9835613330949400  4.0031335045187104
 11.9600897135445070  7.9902977079264668  7.9720554150179908
 11.9567344868668677  7.9570486643222527  4.0031336142952565
 11.9600896909192311  3.9503122837552835  7.9720553411954409
  3.9749826498536445 -0.0000000306352194  3.9908754827953214
  7.9681987723141834  0.0000000473574334  7.9911279433969638
  3.9677670715057443  0.0000000141125962  7.9937288526353436
  7.9677541263279039 -0.0000000060192806  4.0037996600516612
  3.9588999876441111  3.9415170886757278  0.0293486677110253
  7.9884824734138586  8.0142044255715454  0.0635674001310930
  7.9884826258071309  3.9264055230202715  0.0635673658621939
  3.9588999046428186  7.9990930044775439  0.0293487271878918
  3.9518730866541412  3.9651139479361328  3.9994931304356132
  7.9790076255684994  8.0227080176601753  7.9545985017948428
  7.9796895269210966  7.9839587251344426  4.0130352498434583
  3.9403339358705693  3.9242651819385403  7.9513267421519132
  7.9790076455434988  3.9179020042179302  7.9545984446514453
  3.9518730197432266  7.9754960860363013  3.9994932796535556
  3.9403339965828659  8.0163447787018054  7.9513268938778676
  7.9796896430456705  3.9566512610148665  4.0130351611745541
  1.9756713999526372  1.9817565318293817  1.9785662083291420
  9.9322001205156756  9.9632380849941757 10.0353122310096960
  9.9701191429007867  9.9586789917646179  2.0425838297292738
  1.9504470111588728  1.9941577739022074  9.9805492195130014
  9.9321999821307152  1.9773716612195937 10.0353120571750409
  1.9756705910737380  9.9588535098889288  1.9785668967737640
  1.9504471459240929  9.9464521867685463  9.9805497079616181
  9.9701199327616532  1.9819303743612333  2.0425836392160917
  1.9694931156175546  1.9773578370777076  5.9645489079076430
  9.9677398428985189  9.9617707699615874  6.0268363409390915
  9.9677398797422381  1.9788396859637305  6.0268361134876809
  1.9694930881302364  9.9632521063601072  5.9645496724227156
  5.9658229348550327  1.9776339723325220  1.9722203547829256
  5.9660451728110253  9.9827357252776263  9.9836397138751813
  5.9658221706602363  9.9629760090461641  1.9722209302148959
  5.9660449883001547  1.9578744214324328  9.9836392990365184
  1.9619091878720079  5.9703050459814504  1.9562995357306370
 10.1830645511059732  5.9703049459804181 10.0133222310344827
  1.9773647379935735  5.9703049780439486  9.9698214196219048
  9.9459806198631799  5.9703047424984135  2.0378914138960185
  1.9579304564738094  5.9703049673842798  5.9659919691984387
  9.9327040507999378  5.9703052207346321  6.0123260547940243
  5.9630997638705923  1.9843457727264620  5.9592530351177277
  5.9630997642234602  9.9562642507709427  5.9592536312034659
  5.9636549177473270  5.9703050141623857  2.1553456671778068
  5.7488303311768316  5.9703049711367511  9.8726431448642842
  5.9542496880171782  5.9703050005990814  6.0071974946530409
  1.9878589745086603  1.9953612681055539  0.0189657364641782
  9.9685868319898034  9.9441000917398146 11.9856335135578576
  9.9685866780300785  1.9965099464888743 11.9856336430871817
  1.9878589838406575  9.9452486964347937  0.0189653595335146
 11.9622720108015308  1.9890963095799621  2.0036254711284793
 11.9682807669550737  9.9231266080113620 10.0097615684061303
 11.9622724229729691  9.9515136863606664  2.0036255191516670
 11.9682808175899531  2.0174833931966552 10.0097618531821553
  1.9840551154173978 -0.0000000083975623  2.0066812308612016
  9.9742562802040755  0.0000000600511174 10.0034600233304509
  1.9991040012410721  0.0000000231045453 10.0175650119893920
  9.9655161232970961  0.0000001473714618  1.9966414170649212
  1.9820222325495158  1.9882201025539581  4.0219186001499345
  9.9687811346308521  9.9500104689580429  7.9923113887502479
  9.9664963649243710  9.9514124087463252  3.9883240091404186
  1.9867796375991749  1.9892600143661328  8.0310132778789391
  9.9687812221744441  1.9905994915568892  7.9923114445026560
  1.9820223000802075  9.9523898611397090  4.0219183994572685
  1.9867796909495175  9.9513499968136614  8.0310129392559571
  9.9664963034519580  1.9891975889663327  3.9883240318981423
  3.9836734981630486  1.9916983585391335  2.0084630127814780
  7.9832665798991478  9.9612280260095574 10.0107562573153430
  4.0264459605917757  9.9029551149682007 10.0183677516869025
  7.9700221500312649  1.9945569454067864  2.0031589165694155
  7.9700226454132066  9.9460530804975722  2.0031587946702936
  4.0264459661407956  2.0376548687008080 10.0183678988074636
  7.9832666196319710  1.9793819687530321 10.0107561699377889
  3.9836739143569457  9.9489115954947938  2.0084629107815490
  1.9842043934900613  3.9836706553427432  2.0068787155406698
  9.8820566258436511  7.8995890978612717  9.9965777813825607
  9.8820565916583565  4.0410210207028605  9.9965776636033574
  1.9842044641482410  7.9569393104983765  2.0068786707399422
  1.9881836723999082  7.9434552387030779 10.0158132782225540
  9.9674150482068029  3.9858441898855621  1.9995228771502191
  9.9674151167140046  7.9547661463143955  1.9995228796225737
  1.9881836772360688  3.9971547417732811 10.0158134067719669
  1.9848601827710255  5.9703050123636805  0.0101140329993756
  9.8751564896488553  5.9703050283571972 11.9262582391366116
 11.9639642418201468  1.9876495742934264  6.0054783988182567
 11.9639642655676148  9.9529603872960308  6.0054785214582891
  5.9740550554590062  0.0000000115134991  2.0090965587301954
  5.9755021562347332  0.0000000019348994 10.0133835951128134
  5.9786186635703045  1.9910413576654418  0.0177508185206935
  5.9786187120710261  9.9495686207432588  0.0177505040747001
  1.9812516170043009  0.0000000190732724  6.0103983434926729
  9.9667752218655483 11.9406098780882814  5.9987690297018839
  0.0088457604043467  5.9703049844354457 10.0071035283414531
 11.9502417578300069  5.9703050593243461  1.9769666414211422
  1.9871409232387565  5.9703050041142056  4.0220961118990113
  9.8794209901997707  5.9703050281852681  8.0592601491374083
  9.9552234504798740  5.9703050040212684  3.9879070492936495
  1.9944367901507014  5.9703049517648994  8.0481319877116739
  3.9829362518932796  1.9858696245076308  6.0104475474429355
  7.9713892060530602  9.9496507293887007  6.0074614713716441
  3.9829363068892851  9.9547403470024030  6.0104475853093700
  7.9713891635109198  1.9909592067510851  6.0074615146440111
  5.9736742576004014  4.0131854685494632  1.9724808261650313
  6.1228615535214113  7.8214059459199374 10.0703482064180179
  6.1228614837628896  4.1192039174067059 10.0703483755675407
  5.9736743343599814  7.9274245207460332  1.9724807379785692
  5.9787426304776261  2.0138784508010041  8.0497422208315363
  5.9729044604422601  9.9404329604135970  4.0191327871476288
  5.9787426870803877  9.9267315735792288  8.0497417785930843
  5.9729043811694513  2.0001770071099396  4.0191331362706206
  1.9837423967006134  3.9803885582004450  6.0137516276831464
  9.9663694901397530  7.9554037026093463  6.0027993223093992
  9.9663694905944631  3.9852060314352777  6.0027993260090691
  1.9837424063588978  7.9602214068676513  6.0137516624496881
  3.9740513079295736  5.9703049968153588 10.0352297678167783
  7.9495517222745065  5.9703050264784698  1.9845780831574711
  4.0189138782655762  5.9703050228303338  1.9627603604235007
 11.9570403726459507  5.9703049545945905  6.0335258536342744
  5.9743056278366637  0.0000000039152078  6.0171295095206023
  5.9695531116586356  5.9703049929427428  4.0127680979072435
  6.0291803672295901  5.9703049318603512  8.0357269373510611
  4.0036349691741808  5.9703049725968116  6.0295328414370957
  7.9694401559395986  5.9703049713510659  5.9994716280225511
  5.9723954230377396  3.9893753742384628  6.0088135011578663
  5.9723954433085797  7.9512345449394628  6.0088134369285520
  6.0772925359059897  5.9703049585086685 11.9213683465879114
