 Ca Mg S O
   1.0
     8.3830224500000003   -0.0000000100000000    0.0000000000000000
    -4.1915112099999998    7.2599104199999998    0.0000000000000000
     0.0000000000000000    0.0000000000000000    7.3517893399999998
 Ca Mg S O
   2   4   6  24
Direct
   0.0000000000000000  0.0000000000000000  0.0000000000000000
   0.0000000000000000  0.0000000000000000  0.5000000000000000
   0.6666666700000000  0.3333333300000000  0.0478091800000000
   0.3333333300000000  0.6666666700000000  0.9521908200000000
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   0.0384443900000000  0.8397197800000000  0.7500000000000000
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   0.1422523700000000  0.4406074200000000  0.0841420000000000
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   0.5593925799999999  0.7016449300000001  0.0841420000000000