300
Unit cell from CRYSTAL D:\Documenti\Chimica\Dottorato\Superfici\MgCl2a\a_MgCl2\012\012.out for geometry N: 22
Cl 8.1110007005   6.3083695213   8.5642416566
Mg 7.5748705258   4.9261606235   6.7022350929
Cl 12.2807064557   2.7138113889   8.7261463384
Cl 9.2322968801   3.1013984184   6.7623860430
Mg 7.9804791129   1.7695436132   8.5097774031
Cl 6.9887914505   0.4627864879   6.6267127658
Cl 9.7700343322   -0.0342017857   8.5764915850
Mg 8.7651360299   -1.3423541323   6.6927782348
Cl 7.5858443233   -2.6891032947   8.4434914922
Cl 10.5414806094   -3.1474947525   6.7588437038
Mg 9.3753995426   -4.4928486937   8.5102056741
Cl 8.2979751798   -5.7861066829   6.6231704266
Cl 5.0751721999   -5.4371164694   8.2938367389
Mg 9.9554015341   -7.6108688880   6.6833213768
Cl 9.2448779550   -9.0316746017   8.4557414207
Cl 8.2853941049   6.3469663372   4.9298150490
Mg 7.7492639302   4.9647574394   3.0678084853
Cl 12.4550998600   2.7524082048   5.0917197308
Cl 9.4066902845   3.1399952343   3.1279594354
Mg 8.1548725173   1.8081404291   4.8753507955
Cl 7.1631848548   0.5013833038   2.9922861582
Cl 9.9444277366   0.0043950302   4.9420649775
Mg 8.9395294343   -1.3037573164   3.0583516272
Cl 7.7602377277   -2.6505064788   4.8090648846
Cl 10.7158740138   -3.1088979366   3.1244170962
Mg 9.5497929470   -4.4542518778   4.8757790666
Cl 8.4723685842   -5.7475098670   2.9887438191
Cl 5.2495656042   -5.3985196535   4.6594101313
Mg 10.1297949385   -7.5722720721   3.0488947692
Cl 9.4192713594   -8.9930777858   4.8213148131
Cl 8.4597875093   6.3855631531   1.2953884414
Mg 7.9236573346   5.0033542552   -0.5666181223
Cl 12.6294932644   2.7910050207   1.4572931232
Cl 9.5810836889   3.1785920502   -0.5064671722
Mg 8.3292659216   1.8467372450   1.2409241879
Cl 7.3375782592   0.5399801197   -0.6421404493
Cl 10.1188211410   0.0429918461   1.3076383699
Mg 9.1139228387   -1.2651605005   -0.5760749803
Cl 7.9346311320   -2.6119096629   1.1746382770
Cl 10.8902674182   -3.0703011207   -0.5100095113
Mg 9.7241863514   -4.4156550619   1.2413524590
Cl 8.6467619886   -5.7089130511   -0.6456827885
Cl 5.4239590086   -5.3599228376   1.0249835237
Mg 10.3041883429   -7.5336752562   -0.5855318384
Cl 9.5936647637   -8.9544809699   1.1868882055
Cl 8.6341809137   6.4241599690   -2.3390381662
Mg 8.0980507390   5.0419510711   -4.2010447298
Cl 12.8038866688   2.8296018366   -2.1771334844
Cl 9.7554770932   3.2171888660   -4.1408937797
Mg 8.5036593260   1.8853340609   -2.3935024196
Cl 7.5119716636   0.5785769356   -4.2765670569
Cl 10.2932145454   0.0815886619   -2.3267882377
Mg 9.2883162431   -1.2265636846   -4.2105015879
Cl 8.1090245364   -2.5733128470   -2.4597883305
Cl 11.0646608226   -3.0317043048   -4.1444361189
Mg 9.8985797558   -4.3770582460   -2.3930741486
Cl 8.8211553929   -5.6703162352   -4.2801093961
Cl 5.5983524130   -5.3213260217   -2.6094430839
Mg 10.4785817472   -7.4950784403   -4.2199584460
Cl 9.7680581681   -8.9158841540   -2.4475384021
Cl 8.8085743181   6.4627567848   -5.9734647737
Mg 8.2724441433   5.0805478870   -7.8354713374
Cl 12.9782800732   2.8681986525   -5.8115600919
Cl 9.9298704976   3.2557856819   -7.7753203873
Mg 8.6780527304   1.9239308768   -6.0279290272
Cl 7.6863650680   0.6171737515   -7.9109936645
Cl 10.4676079498   0.1201854778   -5.9612148453
Mg 9.4627096475   -1.1879668687   -7.8449281955
Cl 8.2834179408   -2.5347160311   -6.0942149381
Cl 11.2390542270   -2.9931074889   -7.7788627265
Mg 10.0729731602   -4.3384614301   -6.0275007562
Cl 8.9955487973   -5.6317194193   -7.9145360037
Cl 5.7727458174   -5.2827292058   -6.2438696914
Mg 10.6529751516   -7.4564816244   -7.8543850535
Cl 9.9424515725   -8.8772873381   -6.0819650096
Cl 2.0669629357   7.1588723643   8.2832582359
Mg 1.5308327610   5.7766634665   6.4212516722
Cl 6.2366686908   3.5643142320   8.4451629177
Cl 3.1882591153   3.9519012614   6.4814026223
Mg 1.9364413481   2.6200464563   8.2287939824
Cl 0.9447536857   1.3132893310   6.3457293451
Cl 3.7259965674   0.8163010573   8.2955081644
Mg 2.7210982651   -0.4918512892   6.4117948141
Cl 1.5418065585   -1.8386004517   8.1625080715
Cl 4.4974428446   -2.2969919094   6.4778602832
Mg 3.3313617778   -3.6423458506   8.2292222535
Cl 2.2539374150   -4.9356038399   6.3421870060
Cl -0.9688655650   -4.5866136263   8.0128533182
Mg 3.9113637693   -6.7603660450   6.4023379561
Cl 3.2008401902   -8.1811717587   8.1747580000
Cl 2.2413563401   7.1974691802   4.6488316283
Mg 1.7052261654   5.8152602824   2.7868250646
Cl 6.4110620952   3.6029110478   4.8107363101
Cl 3.3626525197   3.9904980773   2.8469760147
Mg 2.1108347524   2.6586432722   4.5943673748
Cl 1.1191470900   1.3518861469   2.7113027376
Cl 3.9003899718   0.8548978732   4.6610815568
Mg 2.8954916695   -0.4532544733   2.7773682066
Cl 1.7161999628   -1.8000036358   4.5280814639
Cl 4.6718362490   -2.2583950936   2.8434336756
Mg 3.5057551822   -3.6037490348   4.5947956459
Cl 2.4283308194   -4.8970070240   2.7077603984
Cl -0.7944721606   -4.5480168104   4.3784267106
Mg 4.0857571737   -6.7217692291   2.7679113485
Cl 3.3752335945   -8.1425749428   4.5403313924
Cl 2.4157497445   7.2360659961   1.0144050207
Mg 1.8796195698   5.8538570983   -0.8476015429
Cl 6.5854554996   3.6415078637   1.1763097025
Cl 3.5370459240   4.0290948932   -0.7874505928
Mg 2.2852281568   2.6972400881   0.9599407673
Cl 1.2935404944   1.3904829628   -0.9231238700
Cl 4.0747833762   0.8934946891   1.0266549492
Mg 3.0698850739   -0.4146576575   -0.8570584010
Cl 1.8905933672   -1.7614068199   0.8936548564
Cl 4.8462296534   -2.2197982777   -0.7909929320
Mg 3.6801485866   -3.5651522189   0.9603690383
Cl 2.6027242238   -4.8584102081   -0.9266662092
Cl -0.6200787562   -4.5094199945   0.7440001030
Mg 4.2601505780   -6.6831724132   -0.8665152591
Cl 3.5496269989   -8.1039781269   0.9059047848
Cl 2.5901431489   7.2746628120   -2.6200215868
Mg 2.0540129741   5.8924539142   -4.4820281505
Cl 6.7598489040   3.6801046796   -2.4581169050
Cl 3.7114393284   4.0676917091   -4.4218772004
Mg 2.4596215612   2.7358369040   -2.6744858403
Cl 1.4679338988   1.4290797786   -4.5575504776
Cl 4.2491767806   0.9320915050   -2.6077716584
Mg 3.2442784783   -0.3760608416   -4.4914850086
Cl 2.0649867716   -1.7228100040   -2.7407717512
Cl 5.0206230578   -2.1812014618   -4.4254195396
Mg 3.8545419910   -3.5265554030   -2.6740575693
Cl 2.7771176281   -4.8198133922   -4.5610928167
Cl -0.4456853518   -4.4708231786   -2.8904265045
Mg 4.4345439824   -6.6445755973   -4.5009418666
Cl 3.7240204033   -8.0653813110   -2.7285218227
Cl 2.7645365533   7.3132596279   -6.2544481944
Mg 2.2284063785   5.9310507301   -8.1164547581
Cl 6.9342423084   3.7187014955   -6.0925435126
Cl 3.8858327328   4.1062885250   -8.0563038080
Mg 2.6340149656   2.7744337198   -6.3089124479
Cl 1.6423273032   1.4676765945   -8.1919770852
Cl 4.4235701850   0.9706883209   -6.2421982659
Mg 3.4186718827   -0.3374640257   -8.1259116162
Cl 2.2393801760   -1.6842131881   -6.3751983588
Cl 5.1950164621   -2.1426046459   -8.0598461471
Mg 4.0289353953   -3.4879585871   -6.3084841768
Cl 2.9515110325   -4.7812165763   -8.1955194243
Cl -0.2712919474   -4.4322263628   -6.5248531121
Mg 4.6089373868   -6.6059787814   -8.1353684742
Cl 3.8984138077   -8.0267844951   -6.3629484303
Cl -3.9770748291   8.0093752073   8.0022748152
Mg -4.5132050038   6.6271663095   6.1402682515
Cl 0.1926309260   4.4148170750   8.1641794970
Cl -2.8557786495   4.8024041044   6.2004192017
Mg -4.1075964167   3.4705492993   7.9478105617
Cl -5.0992840792   2.1637921740   6.0647459245
Cl -2.3180411974   1.6668039003   8.0145247437
Mg -3.3229394997   0.3586515538   6.1308113935
Cl -4.5022312064   -0.9880976086   7.8815246508
Cl -1.5465949202   -1.4464890664   6.1968768625
Mg -2.7126759870   -2.7918430076   7.9482388328
Cl -3.7901003498   -4.0851009968   6.0612035853
Cl -7.0129033298   -3.7361107833   7.7318698975
Mg -2.1326739955   -5.9098632019   6.1213545354
Cl -2.8431975747   -7.3306689156   7.8937745793
Cl -3.8026814247   8.0479720232   4.3678482076
Mg -4.3388115994   6.6657631254   2.5058416440
Cl 0.3670243304   4.4534138909   4.5297528894
Cl -2.6813852452   4.8410009203   2.5659925941
Mg -3.9332030124   3.5091461152   4.3133839542
Cl -4.9248906748   2.2023889899   2.4303193169
Cl -2.1436477930   1.7054007162   4.3800981361
Mg -3.1485460953   0.3972483697   2.4963847859
Cl -4.3278378020   -0.9495007927   4.2470980433
Cl -1.3722015158   -1.4078922505   2.5624502549
Mg -2.5382825826   -2.7532461917   4.3138122252
Cl -3.6157069454   -4.0465041810   2.4267769777
Cl -6.8385099254   -3.6975139674   4.0974432899
Mg -1.9582805912   -5.8712663860   2.4869279278
Cl -2.6688041703   -7.2920720998   4.2593479717
Cl -3.6282880203   8.0865688391   0.7334216001
Mg -4.1644181951   6.7043599413   -1.1285849636
Cl 0.5414177348   4.4920107068   0.8953262819
Cl -2.5069918408   4.8795977362   -1.0684340135
Mg -3.7588096080   3.5477429311   0.6789573466
Cl -4.7504972704   2.2409858058   -1.2041072907
Cl -1.9692543886   1.7439975321   0.7456715285
Mg -2.9741526909   0.4358451856   -1.1380418217
Cl -4.1534443976   -0.9109039769   0.6126714357
Cl -1.1978081114   -1.3692954346   -1.0719763527
Mg -2.3638891782   -2.7146493758   0.6793856176
Cl -3.4413135411   -4.0079073651   -1.2076496298
Cl -6.6641165210   -3.6589171515   0.4630166824
Mg -1.7838871868   -5.8326695702   -1.1474986797
Cl -2.4944107659   -7.2534752839   0.6249213642
Cl -3.4538946159   8.1251656550   -2.9010050075
Mg -3.9900247907   6.7429567572   -4.7630115712
Cl 0.7158111392   4.5306075227   -2.7391003257
Cl -2.3325984364   4.9181945521   -4.7028606211
Mg -3.5844162036   3.5863397470   -2.9554692610
Cl -4.5761038660   2.2795826217   -4.8385338983
Cl -1.7948609842   1.7825943480   -2.8887550790
Mg -2.7997592865   0.4744420015   -4.7724684292
Cl -3.9790509932   -0.8723071610   -3.0217551719
Cl -1.0234147071   -1.3306986187   -4.7064029602
Mg -2.1894957738   -2.6760525599   -2.9550409899
Cl -3.2669201367   -3.9693105492   -4.8420762374
Cl -6.4897231166   -3.6203203356   -3.1714099252
Mg -1.6094937824   -5.7940727543   -4.7819252873
Cl -2.3200173615   -7.2148784680   -3.0095052434
Cl -3.2795012116   8.1637624709   -6.5354316151
Mg -3.8156313863   6.7815535731   -8.3974381788
Cl 0.8902045436   4.5692043386   -6.3735269333
Cl -2.1582050320   4.9567913680   -8.3372872286
Mg -3.4100227992   3.6249365629   -6.5898958686
Cl -4.4017104616   2.3181794376   -8.4729605058
Cl -1.6204675799   1.8211911639   -6.5231816866
Mg -2.6253658822   0.5130388174   -8.4068950368
Cl -3.8046575888   -0.8337103451   -6.6561817795
Cl -0.8490213027   -1.2921018028   -8.3408295678
Mg -2.0151023695   -2.6374557440   -6.5894675975
Cl -3.0925267323   -3.9307137333   -8.4765028450
Cl -6.3153297122   -3.5817235197   -6.8058365328
Mg -1.4351003780   -5.7554759384   -8.4163518949
Cl -2.1456239571   -7.1762816521   -6.6439318510
Cl -10.0211125939   8.8598780504   7.7212913945
Mg -10.5572427686   7.4776691526   5.8592848309
Cl -5.8514068388   5.2653199180   7.8831960763
Cl -8.8998164144   5.6529069475   5.9194357810
Mg -10.1516341816   4.3210521423   7.6668271411
Cl -11.1433218440   3.0142950170   5.7837625038
Cl -8.3620789622   2.5173067434   7.7335413230
Mg -9.3669772645   1.2091543968   5.8498279728
Cl -10.5462689712   -0.1375947656   7.6005412302
Cl -7.5906326850   -0.5959862234   5.9158934418
Mg -8.7567137518   -1.9413401646   7.6672554121
Cl -9.8341381146   -3.2345981538   5.7802201646
Cl -13.0569410946   -2.8856079402   7.4508864768
Mg -8.1767117604   -5.0593603589   5.8403711147
Cl -8.8872353395   -6.4801660726   7.6127911586
Cl -9.8467191895   8.8984748663   4.0868647870
Mg -10.3828493643   7.5162659685   2.2248582233
Cl -5.6770134344   5.3039167339   4.2487694688
Cl -8.7254230100   5.6915037634   2.2850091734
Mg -9.9772407772   4.3596489582   4.0324005335
Cl -10.9689284396   3.0528918329   2.1493358962
Cl -8.1876855578   2.5559035593   4.0991147154
Mg -9.1925838601   1.2477512127   2.2154013652
Cl -10.3718755668   -0.0989979497   3.9661146226
Cl -7.4162392806   -0.5573894075   2.2814668342
Mg -8.5823203474   -1.9027433487   4.0328288045
Cl -9.6597447103   -3.1960013379   2.1457935571
Cl -12.8825476902   -2.8470111244   3.8164598693
Mg -8.0023183560   -5.0207635430   2.2059445072
Cl -8.7128419351   -6.4415692567   3.9783645511
Cl -9.6723257851   8.9370716822   0.4524381794
Mg -10.2084559599   7.5548627844   -1.4095683843
Cl -5.5026200300   5.3425135498   0.6143428612
Cl -8.5510296056   5.7301005793   -1.3494174342
Mg -9.8028473728   4.3982457741   0.3979739259
Cl -10.7945350352   3.0914886488   -1.4850907113
Cl -8.0132921534   2.5945003752   0.4646881079
Mg -9.0181904557   1.2863480286   -1.4190252423
Cl -10.1974821624   -0.0604011338   0.3316880150
Cl -7.2418458762   -0.5187925916   -1.3529597733
Mg -8.4079269430   -1.8641465328   0.3984021970
Cl -9.4853513059   -3.1574045220   -1.4886330505
Cl -12.7081542858   -2.8084143085   0.1820332617
Mg -7.8279249516   -4.9821667271   -1.4284821004
Cl -8.5384485307   -6.4029724408   0.3439379435
Cl -9.4979323808   8.9756684981   -3.1819884282
Mg -10.0340625555   7.5934596003   -5.0439949919
Cl -5.3282266256   5.3811103657   -3.0200837464
Cl -8.3766362012   5.7686973952   -4.9838440417
Mg -9.6284539684   4.4368425900   -3.2364526816
Cl -10.6201416308   3.1300854647   -5.1195173189
Cl -7.8388987491   2.6330971911   -3.1697384997
Mg -8.8437970513   1.3249448445   -5.0534518499
Cl -10.0230887580   -0.0218043179   -3.3027385926
Cl -7.0674524719   -0.4801957757   -4.9873863809
Mg -8.2335335387   -1.8255497169   -3.2360244106
Cl -9.3109579015   -3.1188077061   -5.1230596581
Cl -12.5337608814   -2.7698174926   -3.4523933459
Mg -7.6535315472   -4.9435699112   -5.0629087080
Cl -8.3640551263   -6.3643756249   -3.2904886641
Cl -9.3235389764   9.0142653140   -6.8164150358
Mg -9.8596691511   7.6320564161   -8.6784215994
Cl -5.1538332213   5.4197071816   -6.6545103539
Cl -8.2022427968   5.8072942111   -8.6182706493
Mg -9.4540605640   4.4754394059   -6.8708792892
Cl -10.4457482264   3.1686822806   -8.7539439265
Cl -7.6645053447   2.6716940070   -6.8041651073
Mg -8.6694036470   1.3635416604   -8.6878784575
Cl -9.8486953536   0.0167924980   -6.9371652001
Cl -6.8930590675   -0.4415989598   -8.6218129885
Mg -8.0591401343   -1.7869529010   -6.8704510182
Cl -9.1365644971   -3.0802108902   -8.7574862657
Cl -12.3593674771   -2.7312206767   -7.0868199535
Mg -7.4791381428   -4.9049730953   -8.6973353156
Cl -8.1896617219   -6.3257788090   -6.9249152716
