isolated frozen layer vacuum reference  
   1.00000000000000     
     3.950116    0.000000    0.000000
    -1.975058    3.420900    0.000000
    -0.000000    0.000000   39.402188
   N    Sr
     1     2
Direct
  0.666667  0.333333  0.494857
  0.000000  0.000000  0.534309
  0.333333  0.666667  0.465691
 
   60   60  588
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