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python-ase 3.26.0-2
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file content (111 lines) | stat: -rw-r--r-- 12,349 bytes parent folder | download | duplicates (2)
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unknown system                          
   1.00000000000000     
    -1.745000    1.745000    1.745000
     1.745000   -1.745000    1.745000
     1.745000    1.745000   -1.745000
   Li
     1
Direct
  0.000000  0.000000  0.000000
 
   10   10   10
 0.40155     0.40130     0.52858     0.81819      1.0415      1.1062      1.0415     0.81819     0.52858     0.40130    
 0.40130     0.40785     0.50946     0.76660      1.0084      1.1050      1.0876     0.94326     0.67069     0.45701    
 0.52858     0.50946     0.60934     0.81850      1.0151      1.1036      1.1141      1.0578     0.89457     0.67069    
 0.81819     0.76660     0.81850     0.94191      1.0539      1.1053      1.1164      1.1090      1.0578     0.94326    
  1.0415      1.0084      1.0151      1.0539      1.0926      1.1095      1.1126      1.1164      1.1141      1.0876    
  1.1062      1.1050      1.1036      1.1053      1.1095      1.1117      1.1095      1.1053      1.1036      1.1050    
  1.0415      1.0876      1.1141      1.1164      1.1126      1.1095      1.0926      1.0539      1.0151      1.0084    
 0.81819     0.94326      1.0578      1.1090      1.1164      1.1053      1.0539     0.94191     0.81850     0.76660    
 0.52858     0.67069     0.89457      1.0578      1.1141      1.1036      1.0151     0.81850     0.60934     0.50946    
 0.40130     0.45701     0.67069     0.94326      1.0876      1.1050      1.0084     0.76660     0.50946     0.40785    
 0.40130     0.40785     0.50946     0.76660      1.0084      1.1050      1.0876     0.94326     0.67069     0.45701    
 0.40785     0.40129     0.45700     0.67068     0.94324      1.0876      1.1050      1.0085     0.76661     0.50946    
 0.50946     0.45700     0.50945     0.69070     0.93193      1.0779      1.1156      1.0779     0.93194     0.69072    
 0.76660     0.67068     0.69070     0.81851     0.98242      1.0842      1.1152      1.1112      1.0614     0.93193    
  1.0084     0.94324     0.93193     0.98242      1.0540      1.0992      1.1116      1.1144      1.1112      1.0779    
  1.1050      1.0876      1.0779      1.0842      1.0992      1.1095      1.1112      1.1116      1.1152      1.1156    
  1.0876      1.1050      1.1156      1.1152      1.1116      1.1112      1.1095      1.0992      1.0842      1.0779    
 0.94326      1.0085      1.0779      1.1112      1.1144      1.1116      1.0992      1.0539     0.98241     0.93193    
 0.67069     0.76661     0.93194      1.0614      1.1112      1.1152      1.0842     0.98241     0.81851     0.69072    
 0.45701     0.50946     0.69072     0.93193      1.0779      1.1156      1.0779     0.93193     0.69072     0.50946    
 0.52858     0.50946     0.60934     0.81850      1.0151      1.1036      1.1141      1.0578     0.89457     0.67069    
 0.50946     0.45700     0.50945     0.69070     0.93193      1.0779      1.1156      1.0779     0.93194     0.69072    
 0.60934     0.50945     0.52857     0.67068     0.89457      1.0578      1.1141      1.1036      1.0151     0.81851    
 0.81850     0.69070     0.67068     0.76660     0.93194      1.0614      1.1112      1.1152      1.0842     0.98241    
  1.0151     0.93193     0.89457     0.93194      1.0151      1.0842      1.1103      1.1130      1.1103      1.0842    
  1.1036      1.0779      1.0578      1.0614      1.0842      1.1053      1.1116      1.1104      1.1130      1.1152    
  1.1141      1.1156      1.1141      1.1112      1.1103      1.1116      1.1126      1.1116      1.1103      1.1112    
  1.0578      1.0779      1.1036      1.1152      1.1130      1.1104      1.1116      1.1053      1.0842      1.0614    
 0.89457     0.93194      1.0151      1.0842      1.1103      1.1130      1.1103      1.0842      1.0151     0.93194    
 0.67069     0.69072     0.81851     0.98241      1.0842      1.1152      1.1112      1.0614     0.93194     0.76661    
 0.81819     0.76660     0.81850     0.94191      1.0539      1.1053      1.1164      1.1090      1.0578     0.94326    
 0.76660     0.67068     0.69070     0.81851     0.98242      1.0842      1.1152      1.1112      1.0614     0.93193    
 0.81850     0.69070     0.67068     0.76660     0.93194      1.0614      1.1112      1.1152      1.0842     0.98241    
 0.94191     0.81851     0.76660     0.81819     0.94327      1.0578      1.1090      1.1164      1.1053      1.0539    
  1.0539     0.98242     0.93194     0.94327      1.0085      1.0779      1.1112      1.1144      1.1116      1.0992    
  1.1053      1.0842      1.0614      1.0578      1.0779      1.1036      1.1152      1.1130      1.1104      1.1116    
  1.1164      1.1152      1.1112      1.1090      1.1112      1.1152      1.1164      1.1144      1.1130      1.1144    
  1.1090      1.1112      1.1152      1.1164      1.1144      1.1130      1.1144      1.1164      1.1152      1.1112    
  1.0578      1.0614      1.0842      1.1053      1.1116      1.1104      1.1130      1.1152      1.1036      1.0779    
 0.94326     0.93193     0.98241      1.0539      1.0992      1.1116      1.1144      1.1112      1.0779      1.0085    
  1.0415      1.0084      1.0151      1.0539      1.0926      1.1095      1.1126      1.1164      1.1141      1.0876    
  1.0084     0.94324     0.93193     0.98242      1.0540      1.0992      1.1116      1.1144      1.1112      1.0779    
  1.0151     0.93193     0.89457     0.93194      1.0151      1.0842      1.1103      1.1130      1.1103      1.0842    
  1.0539     0.98242     0.93194     0.94327      1.0085      1.0779      1.1112      1.1144      1.1116      1.0992    
  1.0926      1.0540      1.0151      1.0085      1.0416      1.0876      1.1141      1.1164      1.1126      1.1095    
  1.1095      1.0992      1.0842      1.0779      1.0876      1.1050      1.1156      1.1152      1.1116      1.1112    
  1.1126      1.1116      1.1103      1.1112      1.1141      1.1156      1.1141      1.1112      1.1103      1.1116    
  1.1164      1.1144      1.1130      1.1144      1.1164      1.1152      1.1112      1.1090      1.1112      1.1152    
  1.1141      1.1112      1.1103      1.1116      1.1126      1.1116      1.1103      1.1112      1.1141      1.1156    
  1.0876      1.0779      1.0842      1.0992      1.1095      1.1112      1.1116      1.1152      1.1156      1.1050    
  1.1062      1.1050      1.1036      1.1053      1.1095      1.1117      1.1095      1.1053      1.1036      1.1050    
  1.1050      1.0876      1.0779      1.0842      1.0992      1.1095      1.1112      1.1116      1.1152      1.1156    
  1.1036      1.0779      1.0578      1.0614      1.0842      1.1053      1.1116      1.1104      1.1130      1.1152    
  1.1053      1.0842      1.0614      1.0578      1.0779      1.1036      1.1152      1.1130      1.1104      1.1116    
  1.1095      1.0992      1.0842      1.0779      1.0876      1.1050      1.1156      1.1152      1.1116      1.1112    
  1.1117      1.1095      1.1053      1.1036      1.1050      1.1062      1.1050      1.1036      1.1053      1.1095    
  1.1095      1.1112      1.1116      1.1152      1.1156      1.1050      1.0876      1.0779      1.0842      1.0992    
  1.1053      1.1116      1.1104      1.1130      1.1152      1.1036      1.0779      1.0578      1.0614      1.0842    
  1.1036      1.1152      1.1130      1.1104      1.1116      1.1053      1.0842      1.0614      1.0578      1.0779    
  1.1050      1.1156      1.1152      1.1116      1.1112      1.1095      1.0992      1.0842      1.0779      1.0876    
  1.0415      1.0876      1.1141      1.1164      1.1126      1.1095      1.0926      1.0539      1.0151      1.0084    
  1.0876      1.1050      1.1156      1.1152      1.1116      1.1112      1.1095      1.0992      1.0842      1.0779    
  1.1141      1.1156      1.1141      1.1112      1.1103      1.1116      1.1126      1.1116      1.1103      1.1112    
  1.1164      1.1152      1.1112      1.1090      1.1112      1.1152      1.1164      1.1144      1.1130      1.1144    
  1.1126      1.1116      1.1103      1.1112      1.1141      1.1156      1.1141      1.1112      1.1103      1.1116    
  1.1095      1.1112      1.1116      1.1152      1.1156      1.1050      1.0876      1.0779      1.0842      1.0992    
  1.0926      1.1095      1.1126      1.1164      1.1141      1.0876      1.0416      1.0085      1.0151      1.0540    
  1.0539      1.0992      1.1116      1.1144      1.1112      1.0779      1.0085     0.94327     0.93194     0.98242    
  1.0151      1.0842      1.1103      1.1130      1.1103      1.0842      1.0151     0.93194     0.89457     0.93193    
  1.0084      1.0779      1.1112      1.1144      1.1116      1.0992      1.0540     0.98242     0.93193     0.94324    
 0.81819     0.94326      1.0578      1.1090      1.1164      1.1053      1.0539     0.94191     0.81850     0.76660    
 0.94326      1.0085      1.0779      1.1112      1.1144      1.1116      1.0992      1.0539     0.98241     0.93193    
  1.0578      1.0779      1.1036      1.1152      1.1130      1.1104      1.1116      1.1053      1.0842      1.0614    
  1.1090      1.1112      1.1152      1.1164      1.1144      1.1130      1.1144      1.1164      1.1152      1.1112    
  1.1164      1.1144      1.1130      1.1144      1.1164      1.1152      1.1112      1.1090      1.1112      1.1152    
  1.1053      1.1116      1.1104      1.1130      1.1152      1.1036      1.0779      1.0578      1.0614      1.0842    
  1.0539      1.0992      1.1116      1.1144      1.1112      1.0779      1.0085     0.94327     0.93194     0.98242    
 0.94191      1.0539      1.1053      1.1164      1.1090      1.0578     0.94327     0.81819     0.76660     0.81851    
 0.81850     0.98241      1.0842      1.1152      1.1112      1.0614     0.93194     0.76660     0.67068     0.69070    
 0.76660     0.93193      1.0614      1.1112      1.1152      1.0842     0.98242     0.81851     0.69070     0.67068    
 0.52858     0.67069     0.89457      1.0578      1.1141      1.1036      1.0151     0.81850     0.60934     0.50946    
 0.67069     0.76661     0.93194      1.0614      1.1112      1.1152      1.0842     0.98241     0.81851     0.69072    
 0.89457     0.93194      1.0151      1.0842      1.1103      1.1130      1.1103      1.0842      1.0151     0.93194    
  1.0578      1.0614      1.0842      1.1053      1.1116      1.1104      1.1130      1.1152      1.1036      1.0779    
  1.1141      1.1112      1.1103      1.1116      1.1126      1.1116      1.1103      1.1112      1.1141      1.1156    
  1.1036      1.1152      1.1130      1.1104      1.1116      1.1053      1.0842      1.0614      1.0578      1.0779    
  1.0151      1.0842      1.1103      1.1130      1.1103      1.0842      1.0151     0.93194     0.89457     0.93193    
 0.81850     0.98241      1.0842      1.1152      1.1112      1.0614     0.93194     0.76660     0.67068     0.69070    
 0.60934     0.81851      1.0151      1.1036      1.1141      1.0578     0.89457     0.67068     0.52857     0.50945    
 0.50946     0.69072     0.93194      1.0779      1.1156      1.0779     0.93193     0.69070     0.50945     0.45700    
 0.40130     0.45701     0.67069     0.94326      1.0876      1.1050      1.0084     0.76660     0.50946     0.40785    
 0.45701     0.50946     0.69072     0.93193      1.0779      1.1156      1.0779     0.93193     0.69072     0.50946    
 0.67069     0.69072     0.81851     0.98241      1.0842      1.1152      1.1112      1.0614     0.93194     0.76661    
 0.94326     0.93193     0.98241      1.0539      1.0992      1.1116      1.1144      1.1112      1.0779      1.0085    
  1.0876      1.0779      1.0842      1.0992      1.1095      1.1112      1.1116      1.1152      1.1156      1.1050    
  1.1050      1.1156      1.1152      1.1116      1.1112      1.1095      1.0992      1.0842      1.0779      1.0876    
  1.0084      1.0779      1.1112      1.1144      1.1116      1.0992      1.0540     0.98242     0.93193     0.94324    
 0.76660     0.93193      1.0614      1.1112      1.1152      1.0842     0.98242     0.81851     0.69070     0.67068    
 0.50946     0.69072     0.93194      1.0779      1.1156      1.0779     0.93193     0.69070     0.50945     0.45700    
 0.40785     0.50946     0.76661      1.0085      1.1050      1.0876     0.94324     0.67068     0.45700     0.40129