 Sc H O
   1.0
    10.2181120799999992    0.0000000000000000    0.0000000000000000
     0.0000000000000000    3.2014780100000002    0.0000000000000000
     0.0000000000000000    0.0000000000000000    4.7266773999999998
 Sc H O
   4   4   8
Direct
   0.8572262500000000  0.7500000000000000  0.9218844500000000
   0.3572262500000000  0.7500000000000000  0.5781155499999999
   0.1427737500000000  0.2500000000000000  0.0781155500000000
   0.6427737499999999  0.2500000000000000  0.4218844500000000
   0.0980665800000000  0.7500000000000000  0.6109804300000000
   0.5980665800000000  0.7500000000000000  0.8890195700000000
   0.9019334200000000  0.2500000000000000  0.3890195700000000
   0.4019334200000000  0.2500000000000000  0.1109804300000000
   0.1914482800000000  0.7500000000000000  0.3297737300000000
   0.6914482800000000  0.7500000000000000  0.1702262700000000
   0.8085517200000000  0.2500000000000000  0.6702262700000000
   0.3085517200000000  0.2500000000000000  0.8297737300000000
   0.0619782400000000  0.7500000000000000  0.8114628800000000
   0.5619782400000000  0.7500000000000000  0.6885371200000000
   0.9380217600000000  0.2500000000000000  0.1885371200000000
   0.4380217600000000  0.2500000000000000  0.3114628800000000