 H O Mg Se
   1.0
     6.8634541699999998    0.0000000000000000   -0.0348548500000000
     0.0000000000000000    8.2230477000000004    0.0000000000000000
    -3.3804757200000002    0.0000000000000000    6.8544493299999996
 H O Mg Se
   8  20   4   4
Direct
   0.5867608700000000  0.4486805900000000  0.2040490800000000
   0.9132391300000000  0.9486805900000000  0.2959509200000000
   0.9132391300000000  0.0513194100000000  0.7959509200000000
   0.5867608700000000  0.5513194100000001  0.7040490800000000
   0.0867608700000000  0.9486805900000000  0.2040490800000000
   0.4132391300000000  0.4486805900000000  0.2959509200000000
   0.4132391300000000  0.5513194100000001  0.7959509200000000
   0.0867608700000000  0.0513194100000000  0.7040490800000000
   0.0113435600000000  0.6943452700000000  0.5765384300000000
   0.9886564400000000  0.6943452700000000  0.9234615700000000
   0.4886564400000000  0.8056547300000000  0.4234615700000000
   0.5113435600000000  0.8056547300000000  0.0765384300000000
   0.7227739799999999  0.9644862900000000  0.8458103400000000
   0.7772260200000000  0.4644862900000000  0.6541896600000000
   0.7772260200000000  0.5355137100000000  0.1541896600000000
   0.7227739799999999  0.0355137100000000  0.3458103400000000
   0.5000000000000000  0.6246233800000001  0.7500000000000000
   0.0000000000000000  0.8753766199999999  0.2500000000000000
   0.5113435600000000  0.1943452700000000  0.5765384300000000
   0.4886564400000000  0.1943452700000000  0.9234615700000000
   0.9886564400000000  0.3056547300000000  0.4234615700000000
   0.0113435600000000  0.3056547300000000  0.0765384300000000
   0.2227739800000000  0.4644862900000000  0.8458103400000000
   0.2772260200000000  0.9644862900000000  0.6541896600000000
   0.2772260200000000  0.0355137100000000  0.1541896600000000
   0.2227739800000000  0.5355137100000000  0.3458103400000000
   0.0000000000000000  0.1246233800000000  0.7500000000000000
   0.5000000000000000  0.3753766200000000  0.2500000000000000
   0.7500000000000000  0.7500000000000000  0.0000000000000000
   0.7500000000000000  0.2500000000000000  0.5000000000000000
   0.2500000000000000  0.2500000000000000  0.0000000000000000
   0.2500000000000000  0.7500000000000000  0.5000000000000000
   0.0000000000000000  0.5817138200000000  0.7500000000000000
   0.5000000000000000  0.9182861800000000  0.2500000000000000
   0.5000000000000000  0.0817138200000000  0.7500000000000000
   0.0000000000000000  0.4182861800000000  0.2500000000000000