xcrysden xsf file MA2PbI4               
   1.00000000000000     
    12.1509345670038300    0.0382633571702303   -0.0059291323030911
    -0.0425531913278041   11.8792835604452538   -0.0010831563664147
     0.1990432205879681    0.6465826980959369   32.3142169576918761
   N    Pb   Sn   I    C    H 
     8     2     2    16     8    48
Direct
  0.0821312820618039  0.5209632753813553  0.4473425892997995
  0.0448677741459776  0.0197396812691677  0.4411251376545839
  0.5415671884460804  0.5175937497288166  0.4432234059742694
  0.9364031045855518  0.0086841051753197  0.6130815645198294
  0.4321903431070470  0.5105098799479952  0.6151478142855430
  0.5844199980955525  0.0194570266089127  0.4455825044757279
  0.3938421950279506  0.0115637681466510  0.6108842313587045
  0.8914753272252137  0.5104300230297142  0.6125813888747764
  0.7397036409804616  0.2650231947801895  0.5283558636943452
  0.7389806530598092  0.7649212632264302  0.5287744106938228
  0.2390153269965819  0.2653853460166702  0.5282579422414218
  0.2395915667910642  0.7653741025353098  0.5287688425522900
  0.2226890850935423  0.2582612005796407  0.4292939998358689
  0.2243818141220877  0.7838386323553812  0.4298308128786228
  0.7240776073857839  0.2850545996737597  0.4279637374887644
  0.7211887852028451  0.7546968515587974  0.4284787772325505
  0.2523545843345938  0.2737544104626057  0.6272307050119182
  0.2532627583644683  0.7468594674558835  0.6276955971266805
  0.7548775522202853  0.2428067893146642  0.6286002729928973
  0.7528491352495099  0.7747814653032937  0.6290818936906106
  0.1642020259752416  0.0145465228080013  0.5413053178850468
  0.3145277864434861  0.5159734548766085  0.5149982742855380
  0.8203473981451650  0.0158322310188662  0.5124404903794333
  0.6576770363519385  0.5140525843193318  0.5439580637711857
  0.4870985254920596  0.1946396936891815  0.5275697289696313
  0.4872258074775515  0.8371945632141048  0.5282368317117595
  0.9917070153954423  0.3372188466674386  0.5305446031651996
  0.9918515528328226  0.6949448037961241  0.5310336402865372
  0.4627967222660685  0.5190369454750213  0.4081427409112002
  0.0163968656511110  0.0068526295308833  0.6477805982585778
  0.5138867541877123  0.5066428145600754  0.6492340801220806
  0.9956684586845649  0.5089670037864309  0.6365854845297433
  0.4992627092127452  0.0101968467729653  0.6340955103516912
  0.4787361874106709  0.0203009558171235  0.4225392086066214
  0.9743817297583056  0.5245744052070456  0.4257119303497930
  0.9638857357756317  0.0195433677514855  0.4067795924975983
  0.5099167393655082  0.5200359008467897  0.3791342871027436
  0.4694138403672745  0.5039717452872871  0.6788263300025593
  0.4807874048550689  0.0086620292065439  0.6673241767647755
  0.4322375382993204  0.0957629344197192  0.4308723703856223
  0.5461976954056982  0.0861911544465537  0.6255866570102089
  0.4114522310725990  0.5947123815458898  0.4102312343211363
  0.5656835973135671  0.5822376510964846  0.6468308336873810
  0.9121799820694685  0.0949337646851570  0.4090122544420738
  0.9293988980494251  0.5996692382278842  0.4354545870202705
  0.5647616937645275  0.4310074339847902  0.6459089102259704
  0.5457726135284768  0.9347824353219122  0.6257095715885156
  0.0952283070910544  0.0913309162812564  0.4396672804611265
  0.1291184304201601  0.5929349471104550  0.4407662123952805
  0.3471898498890909  0.0831932623066316  0.6171756623638631
  0.6311860015375464  0.0915656790296512  0.4390108658595485
  0.3818138006231336  0.5818275551084333  0.6167712171728114
  0.5923333193642473  0.5888354536580568  0.4422943644424276
  0.3807395641920908  0.4397225607577784  0.6161108168345308
  0.3470541549024040  0.9393301715977312  0.6172097335093067
  0.0043474713414237  0.0188452929171837  0.4695156644277781
  0.0696979106424633  0.5180667941347693  0.4790700733788500
  0.5689393763494895  0.0184066920754580  0.4771286567269897
  0.4094762926722283  0.0131938652782297  0.5793435252798488
  0.4994929547281764  0.5160901247917261  0.4712912876799438
  0.4720764059290662  0.5127491594133735  0.5866406802147656
  0.4969096632202976  0.0213299643376842  0.3892940121391924
  0.9892995875396355  0.5283353727765150  0.3922539471177081
  0.0090211284248474  0.0199282378163703  0.3773356845360656
  0.4111824582819139  0.4433207763331450  0.4105527036009742
  0.4320883737231438  0.9443370415113381  0.4313126767531368
  0.9277428122443990  0.4483766245147044  0.4341966957913862
  0.9128065762263917  0.9436253007663677  0.4099709407634918
  0.1273877812471156  0.4491887289129370  0.4400296048179557
  0.0963573399250659  0.9491022370034887  0.4403304695249838
  0.5928504069803497  0.4468645477017444  0.4423507065794066
  0.6308742470110953  0.9476096369951662  0.4393835990988018
  0.0427808884434329  0.5851897260197735  0.6285411512836028
  0.0427743359875450  0.4338070692869706  0.6283738485314964
  0.9753129227699119  0.5069199540728240  0.6696546046216757
  0.9089347715757957  0.5124362575278133  0.5811714426620082
  0.8444278397025098  0.5819738864195639  0.6186501366429219
  0.8445865265872569  0.4379850382141727  0.6184593153568452
  0.0676679322374136  0.0827937702575393  0.6452910865427066
  0.0679059312876967  0.9314115362082047  0.6452335229176218
  0.9702577030173333  0.0051346818681301  0.6770123973247081
  0.9774611496913341  0.0100780825036894  0.5848127360360408
  0.8855441244615178  0.0796712837604903  0.6141790302530822
  0.8852073600837408  0.9377821958203695  0.6142849578411974
 
  0.00000000E+00  0.00000000E+00  0.00000000E+00
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  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
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  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
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  0.00000000E+00  0.00000000E+00  0.00000000E+00
