XYZ file
1.0
       27.1567363739         0.0000000000         0.0000000000
        0.0000000000        27.1567363739         0.0000000000
        0.0000000000         0.0000000000        27.1567363739
    H    C    O    N   Al
   59   71   15   15   15
Cartesian
    15.085677954         7.148423093        15.526183780
    11.776057864        13.985544028        16.432393231
    14.425798961         8.966893384        17.008354020
    11.090808684         9.751683339        16.079651564
    18.573568384        21.328344822        18.943251027
     8.305049328        17.965593587        18.459042793
    11.240248126        21.429943733        15.843542992
     5.946928200        20.863952318        15.607861748
    16.093657895         8.638203499        23.181703066
    10.336458583        19.091003007        22.090332607
    14.796418812        19.350873620        17.164403291
    20.174149017         9.991203253        20.681282439
     7.241038398        16.525482806        20.429131253
    10.944147685        18.386882591        17.358110864
    18.927719911         5.602403699        22.778573894
    10.711657645        14.834902635        18.698069823
    20.856548533         6.608343309        23.855052611
    10.009959564        12.697873699        18.279373924
    19.362867947         5.948493452        16.719313398
     7.411807833        19.807153362        17.113062391
    10.728698168         7.441923144        17.170562321
    21.518878189        18.614313485        16.591072837
    17.103428082         9.582863590        17.123282659
     9.762008011        21.452244117        21.680181655
    15.273007977        21.150163509        18.770911485
    15.938209149         9.949002969        18.962390153
    11.872088558        15.902802414        20.364350556
     8.477357306        21.442734445        15.237523545
    15.600328469         6.601553808        22.328022617
    11.923137288        17.663653803        20.603813007
    13.360438062        10.146763686        19.837584313
    11.505538037        17.009613343        19.011973179
    21.212716919         7.161313352        20.226943480
     5.917688184        14.688613929        20.290830672
     9.094327849        16.746633270        17.162371863
    17.828877682        20.616173153        20.625412508
    10.554837888        17.148773436        22.622760949
    13.280788284        16.984443062        15.084431580
    17.053268809        21.017851999        22.163862202
     8.839148135        16.694573682        22.431343790
    14.632318288        17.968673911        15.665402145
    16.071898146        20.903913985        20.704463379
    10.115378530        15.482683706        22.204110373
    13.324107876        17.497803499        16.785123568
    16.030638308        15.693562106        19.049811154
    18.944609089        12.858933556        17.616442124
    20.740917392        14.283013052        21.327292689
    17.203757957        12.364243640        19.797062588
     8.728568047        12.798803291        23.105303573
    14.708377861        15.377643508        16.973222458
    17.628158040        12.559023581        15.539422862
    19.383586893        16.461364144        18.657943052
    20.052287624        14.933893872        17.025871241
    20.486527588        15.750063318        19.810693388
     5.348938154        11.580443500        23.630232628
    17.072097151        15.226252762        21.104801968
    18.677818672        15.904592660        21.413583860
    17.653618063        16.625972930        20.153352375
    19.467537470        10.581072443        23.030862668
    14.962128291         8.138233489        15.089910770
    11.357798197        13.149863163        15.871392168
    14.586338416         9.174523927        15.952782014
    10.961647910        10.757713595        15.674162374
    11.495168043        11.854283214        16.346171663
    14.413429103        10.443823187        15.420691974
    13.546627733        11.399063700        17.438370880
    18.186978758         6.153333007        18.533341256
     8.695068102        18.714394086        19.145482504
    12.132748271        21.361754122        16.472372703
     6.101378632        19.958773958        15.015622019
    16.954097900         8.198553138        18.777052710
     9.791458049        19.333482655        21.180432594
    14.105929195        20.185762957        17.216122959
    17.352348408         6.958644026        19.332513073
     9.405287658        18.312053205        20.286813139
    12.963518099        20.220591828        16.396151263
    17.217448648         6.630463212        20.846522505
     9.902088316        16.857563800        20.522282337
    12.744478377        19.081653583        15.364302449
    18.568548896         7.138573500        21.383541389
     9.098288728        15.697974594        19.857833845
    11.310168092        18.529082541        15.230072818
    20.117958589         8.904983394        20.772923307
     7.741818551        15.627772979        20.046931453
    10.609058397        18.082692859        16.365033996
    19.354378035         6.493663136        22.315223812
     9.787108689        14.579973815        19.225213215
    20.574236712         6.961662841        22.860360313
     9.391828437        13.264563569        18.978793730
    18.645398378         6.549073366        17.279621671
     8.479077950        20.070614179        18.845501307
    12.400679039         6.302233028        17.386911817
     5.812847891        18.715763479        15.581032332
    17.389927395         8.609793454        17.510633059
     9.502688554        20.686593288        20.946292322
    14.393627942        21.207893290        18.131914922
    15.947508395         7.287223842        21.546919987
    11.387058042        16.852652762        20.093333798
    21.390098611         8.117083169        20.758201525
     6.890868794        14.458453961        19.846169726
     9.537228493        17.184715951        16.266452282
    21.486318689         7.807683755        22.251943620
     7.296018063        13.066292972        20.319411487
     9.110808313        16.787603367        15.004422458
    18.254189075         7.798203219        16.791650036
     8.873988337        21.044874036        19.764902900
    13.528598204         6.172283154        18.240341373
     6.084478528        17.570771417        14.833852119
    18.837628108         9.436592690        15.086383693
     7.617928968         6.552843243        18.405843663
    17.890417806        18.547715025        16.712652581
     7.093638478        15.559313050        15.663043746
    17.047347723        21.230344210        21.087399672
     9.852678487        16.536423381        22.040013086
    13.551948294        17.809982974        15.756491047
    16.420868318        15.037763773        18.273142054
    18.042108005        13.451433081        17.464471895
    17.647258318        14.379323776        18.454002262
    18.586448122        14.705333147        19.609811880
    18.949698180        13.458943699        20.434841912
    20.055607512        13.439593337        21.295361232
    18.046557723        12.380133291        20.491171546
    18.191598435        11.354433796        21.441803711
    15.660738764        14.865862890        17.110173070
    17.307108266        13.278943812        16.291374908
    19.805528220        15.496664138        18.984701867
    20.312457690        12.376263866        22.194173372
    19.305177014        11.391193738        22.310552337
    16.145558853        14.028443576        16.116233452
    17.949648092        15.677244317        20.624363611
    13.989278294        11.563293717        16.170342273
    12.216978069        11.644512793        17.571723193
    14.244388405        11.119563505        18.406753354
    18.875307453         8.165663431        15.584912279
     8.640678441         6.325543460        19.441452642
    13.598368444         7.161773863        19.233521836
     6.002588919        16.333214228        15.546311912
     6.343838047         8.341973565        23.008131718
    16.866259283        18.727354758        16.142601547
     8.132608619        15.755723798        14.821572907
    18.029459736        10.318224292        15.322741540
     7.193978874         7.783643303        18.354253489
    18.917447846        18.370783322        17.284152322
     7.090508784        14.581853088        16.442993885
    15.346798178        13.866903784        14.950862365
     8.393848625        12.474733083        19.560772726
     7.942128669        20.504413865        17.630932437
    16.115869252         8.659813521        22.162143177
    20.569625128        14.907263552        17.903823611
    21.526158956        12.304393405        22.909232745
    18.887327679         8.436323272        20.953710675
    13.082528208         9.335372547        20.425403461
     7.245698542         5.626023297        17.600752379
    16.196558214         9.150683381        19.556282542
    11.638958335         7.451432816        17.629692537
     9.278508754         7.748363633        22.339830797
     8.029029269        10.675123507        22.076382929
    14.766607810        16.820543253        22.904051390
    10.641358100        11.260293705        21.055222178
    14.462738574        16.259433739        21.984580195
    14.667359205         8.235973497        20.424891962
    11.947918280         8.092093369        19.385542243
     8.934817866        10.755773621        20.371971243
     6.031618509        13.985833769        18.035350068
     7.098687911        12.289992928        22.091711712
     6.630348286        11.655043844        18.825232351
     6.868817685         9.075553732        19.619531979
     7.859558006         8.882572941        22.319972983
     9.612248073         7.932963773        20.513659695
    17.297598594         9.649323655        21.167093154
    11.968408185        10.095392841        21.825372903
    11.581137909        12.905793174        20.777013680
    11.824218082        10.414483218        24.441063708
     9.697276683        11.284893407        22.923922154
    10.515797243         8.542572615        23.455809860
