$cell vectors
1.0
 11.7822944559356912    0.0000000000000000    0.0000000000000000
  0.0000000000000000   11.7822944559356912    0.0000000000000000
  0.0000000000000000    0.0000000000000000   23.6384888770983430
 96 64
Direct
  0.3530000000000001    0.1297999999999999    0.0615000000000001 # Zn1
  0.1072000000000002    0.3590000000000000    0.0468000000000000 # Zn2
  0.3871000000000001    0.3841000000000001    0.0639000000000000 # Zn3
  0.0980999999999999    0.1025999999999999    0.1757000000000000 # Zn4
  0.3848999999999997    0.1440000000000002    0.1866000000000000 # Zn5
  0.1363000000000001    0.3760999999999999    0.1892000000000000 # Zn6
  0.8529999999999998    0.6298000000000001    0.5615000000000002 # Zn7
  0.6072000000000000    0.8590000000000003    0.5468000000000001 # Zn8
  0.8871000000000000    0.8840999999999999    0.5639000000000000 # Zn9
  0.5981000000000001    0.6026000000000001    0.6757000000000001 # Zn10
  0.8849000000000000    0.6439999999999999    0.6866000000000001 # Zn11
  0.6363000000000003    0.8761000000000002    0.6892000000000001 # Zn12
  0.8702000000000001    0.8529999999999998    0.3115000000000001 # Zn13
  0.6409999999999999    0.6072000000000000    0.2968000000000000 # Zn14
  0.6158999999999999    0.8871000000000000    0.3139000000000000 # Zn15
  0.8973999999999994    0.5981000000000001    0.4257000000000001 # Zn16
  0.8559999999999998    0.8849000000000000    0.4366000000000000 # Zn17
  0.6239000000000000    0.6363000000000003    0.4392000000000001 # Zn18
  0.3701999999999999    0.3530000000000001    0.8114999999999999 # Zn19
  0.1410000000000002    0.1072000000000002    0.7968000000000002 # Zn20
  0.1159000000000002    0.3871000000000001    0.8139000000000003 # Zn21
  0.3973999999999998    0.0981000000000004    0.9257000000000002 # Zn22
  0.3560000000000001    0.3849000000000002    0.9366000000000002 # Zn23
  0.1239000000000002    0.1363000000000001    0.9392000000000001 # Zn24
  0.6469999999999998    0.8702000000000001    0.0615000000000001 # Zn25
  0.8927999999999999    0.6409999999999999    0.0468000000000000 # Zn26
  0.6128999999999999    0.6158999999999999    0.0639000000000000 # Zn27
  0.9019000000000000    0.8974000000000001    0.1757000000000000 # Zn28
  0.6150999999999998    0.8559999999999998    0.1866000000000000 # Zn29
  0.8637000000000000    0.6239000000000000    0.1892000000000000 # Zn30
  0.1470000000000001    0.3702000000000004    0.5615000000000002 # Zn31
  0.3928000000000001    0.1410000000000002    0.5468000000000001 # Zn32
  0.1129000000000002    0.1159000000000002    0.5639000000000000 # Zn33
  0.4018999999999999    0.3973999999999998    0.6757000000000001 # Zn34
  0.1151000000000000    0.3560000000000001    0.6866000000000001 # Zn35
  0.3637000000000002    0.1239000000000002    0.6892000000000001 # Zn36
  0.1297999999999999    0.1470000000000001    0.3115000000000001 # Zn37
  0.3590000000000000    0.3928000000000001    0.2968000000000000 # Zn38
  0.3841000000000001    0.1129000000000002    0.3139000000000000 # Zn39
  0.1025999999999999    0.4018999999999999    0.4257000000000001 # Zn40
  0.1440000000000002    0.1151000000000000    0.4366000000000000 # Zn41
  0.3760999999999999    0.3637000000000002    0.4392000000000001 # Zn42
  0.6298000000000001    0.6469999999999998    0.8114999999999999 # Zn43
  0.8590000000000003    0.8927999999999999    0.7968000000000002 # Zn44
  0.8840999999999999    0.6128999999999999    0.8139000000000003 # Zn45
  0.6026000000000001    0.9019000000000000    0.9257000000000002 # Zn46
  0.6439999999999999    0.6151000000000002    0.9366000000000002 # Zn47
  0.8761000000000002    0.8637000000000000    0.9392000000000001 # Zn48
  0.6469999999999998    0.1297999999999999    0.5615000000000002 # Zn49
  0.8927999999999999    0.3590000000000000    0.5468000000000001 # Zn50
  0.6128999999999999    0.3841000000000001    0.5639000000000000 # Zn51
  0.9019000000000000    0.1025999999999999    0.6757000000000001 # Zn52
  0.6150999999999998    0.1440000000000002    0.6866000000000001 # Zn53
  0.8637000000000000    0.3760999999999999    0.6892000000000001 # Zn54
  0.1470000000000001    0.6298000000000001    0.0615000000000001 # Zn55
  0.3928000000000001    0.8590000000000000    0.0468000000000000 # Zn56
  0.1129000000000002    0.8840999999999999    0.0639000000000000 # Zn57
  0.4018999999999999    0.6026000000000001    0.1757000000000000 # Zn58
  0.1151000000000000    0.6439999999999999    0.1866000000000000 # Zn59
  0.3637000000000002    0.8760999999999997    0.1892000000000000 # Zn60
  0.3530000000000001    0.8702000000000001    0.5615000000000002 # Zn61
  0.1072000000000002    0.6409999999999999    0.5468000000000001 # Zn62
  0.3871000000000001    0.6159000000000003    0.5639000000000000 # Zn63
  0.0980999999999999    0.8974000000000001    0.6757000000000001 # Zn64
  0.3849000000000002    0.8560000000000003    0.6866000000000001 # Zn65
  0.1363000000000001    0.6239000000000000    0.6892000000000001 # Zn66
  0.8529999999999998    0.3701999999999999    0.0615000000000001 # Zn67
  0.6072000000000000    0.1410000000000002    0.0468000000000000 # Zn68
  0.8871000000000000    0.1159000000000002    0.0639000000000000 # Zn69
  0.5980999999999996    0.3973999999999998    0.1757000000000000 # Zn70
  0.8849000000000000    0.3560000000000001    0.1866000000000000 # Zn71
  0.6362999999999998    0.1238999999999998    0.1892000000000000 # Zn72
  0.3702000000000004    0.6469999999999998    0.3115000000000001 # Zn73
  0.1410000000000002    0.8927999999999999    0.2968000000000000 # Zn74
  0.1159000000000002    0.6128999999999999    0.3139000000000000 # Zn75
  0.3973999999999998    0.9019000000000000    0.4257000000000001 # Zn76
  0.3560000000000001    0.6150999999999998    0.4366000000000000 # Zn77
  0.1239000000000002    0.8637000000000000    0.4392000000000001 # Zn78
  0.8702000000000001    0.1470000000000001    0.8114999999999999 # Zn79
  0.6409999999999999    0.3928000000000001    0.7968000000000002 # Zn80
  0.6158999999999999    0.1129000000000002    0.8139000000000003 # Zn81
  0.8974000000000001    0.4019000000000003    0.9257000000000002 # Zn82
  0.8560000000000003    0.1151000000000000    0.9366000000000002 # Zn83
  0.6239000000000000    0.3637000000000002    0.9392000000000001 # Zn84
  0.6298000000000001    0.3530000000000001    0.3115000000000001 # Zn85
  0.8590000000000000    0.1072000000000002    0.2968000000000000 # Zn86
  0.8840999999999999    0.3871000000000001    0.3139000000000000 # Zn87
  0.6026000000000001    0.0980999999999999    0.4257000000000001 # Zn88
  0.6439999999999999    0.3849000000000002    0.4366000000000000 # Zn89
  0.8760999999999997    0.1363000000000001    0.4392000000000001 # Zn90
  0.1297999999999999    0.8529999999999998    0.8114999999999999 # Zn91
  0.3590000000000000    0.6072000000000000    0.7968000000000002 # Zn92
  0.3841000000000001    0.8871000000000000    0.8139000000000003 # Zn93
  0.1025999999999999    0.5981000000000001    0.9257000000000002 # Zn94
  0.1440000000000002    0.8849000000000000    0.9366000000000002 # Zn95
  0.3761000000000003    0.6363000000000003    0.9392000000000001 # Zn96
  0.0000000000000000    0.0000000000000000    0.0000000000000000 # As1
  0.0000000000000000    0.0000000000000000    0.2469000000000000 # As2
  0.0072000000000000    0.2496000000000000    0.1227000000000001 # As3
  0.2565999999999998    0.9964999999999998    0.1249000000000001 # As4
  0.2571000000000000    0.2515000000000003    0.9980000000000000 # As5
  0.5000000000000002    0.4999999999999998    0.5000000000000000 # As6
  0.4999999999999998    0.5000000000000002    0.7469000000000003 # As7
  0.5072000000000002    0.7496000000000003    0.6227000000000001 # As8
  0.7566000000000001    0.4965000000000000    0.6249000000000001 # As9
  0.7570999999999997    0.7515000000000001    0.4980000000000001 # As10
  0.0000000000000000    0.4999999999999998    0.2500000000000000 # As11
  0.0000000000000000    0.4999999999999998    0.4969000000000001 # As12
  0.7504000000000000    0.5072000000000002    0.3727000000000001 # As13
  0.0035000000000001    0.7566000000000001    0.3749000000000001 # As14
  0.7484999999999996    0.7570999999999997    0.2479999999999999 # As15
  0.4999999999999998    0.0000000000000000    0.7500000000000002 # As16
  0.5000000000000002    0.0000000000000000    0.9969000000000000 # As17
  0.2504000000000002    0.0072000000000004    0.8727000000000000 # As18
  0.5034999999999999    0.2566000000000003    0.8749000000000002 # As19
  0.2484999999999999    0.2571000000000000    0.7479999999999999 # As20
  0.9927999999999996    0.7504000000000000    0.1227000000000001 # As21
  0.7434000000000002    0.0035000000000001    0.1249000000000001 # As22
  0.7428999999999999    0.7485000000000003    0.9980000000000000 # As23
  0.4928000000000002    0.2504000000000002    0.6227000000000001 # As24
  0.2433999999999999    0.5034999999999999    0.6249000000000001 # As25
  0.2429000000000002    0.2484999999999999    0.4980000000000001 # As26
  0.2496000000000000    0.4928000000000002    0.3727000000000001 # As27
  0.9964999999999998    0.2433999999999999    0.3749000000000001 # As28
  0.2514999999999999    0.2428999999999998    0.2479999999999999 # As29
  0.7496000000000003    0.9928000000000001    0.8727000000000000 # As30
  0.4965000000000000    0.7434000000000002    0.8749000000000002 # As31
  0.7515000000000001    0.7428999999999999    0.7479999999999999 # As32
  0.0000000000000000    0.0000000000000000    0.5000000000000000 # As33
  0.0000000000000000    0.0000000000000000    0.7469000000000003 # As34
  0.9928000000000001    0.2496000000000000    0.6227000000000001 # As35
  0.7434000000000002    0.9965000000000003    0.6249000000000001 # As36
  0.7428999999999999    0.2515000000000003    0.4980000000000001 # As37
  0.4999999999999998    0.4999999999999998    0.0000000000000000 # As38
  0.4999999999999998    0.4999999999999998    0.2469000000000000 # As39
  0.4928000000000002    0.7495999999999997    0.1227000000000001 # As40
  0.2433999999999999    0.4965000000000000    0.1249000000000001 # As41
  0.2429000000000002    0.7515000000000001    0.9980000000000000 # As42
  0.0072000000000000    0.7504000000000000    0.6227000000000001 # As43
  0.2565999999999998    0.0035000000000001    0.6249000000000001 # As44
  0.2571000000000000    0.7485000000000003    0.4980000000000001 # As45
  0.5071999999999998    0.2504000000000002    0.1227000000000001 # As46
  0.7566000000000001    0.5034999999999999    0.1249000000000001 # As47
  0.7571000000000002    0.2485000000000003    0.9980000000000000 # As48
  0.4999999999999998    0.0000000000000000    0.2500000000000000 # As49
  0.4999999999999998    0.0000000000000000    0.4969000000000001 # As50
  0.2504000000000002    0.9928000000000001    0.3727000000000001 # As51
  0.5034999999999999    0.7434000000000002    0.3749000000000001 # As52
  0.2484999999999999    0.7428999999999999    0.2479999999999999 # As53
  0.0000000000000000    0.5000000000000002    0.7500000000000002 # As54
  0.0000000000000000    0.5000000000000002    0.9969000000000000 # As55
  0.7504000000000000    0.4928000000000002    0.8727000000000000 # As56
  0.0035000000000001    0.2434000000000004    0.8749000000000002 # As57
  0.7485000000000003    0.2429000000000002    0.7479999999999999 # As58
  0.7496000000000003    0.0072000000000000    0.3727000000000001 # As59
  0.4965000000000000    0.2565999999999998    0.3749000000000001 # As60
  0.7514999999999996    0.2571000000000000    0.2479999999999999 # As61
  0.2496000000000000    0.5072000000000002    0.8727000000000000 # As62
  0.9965000000000003    0.7566000000000001    0.8749000000000002 # As63
  0.2515000000000003    0.7571000000000002    0.7479999999999999 # As64
