 La H O
   1.0
     6.4317457700000000    0.0000000400000000    0.0000000000000000
    -3.2158729099999999    5.5700552099999996    0.0000000000000000
     0.0000000000000000    0.0000000000000000    3.7961644500000000
 La H O
   2   6   6
Direct
   0.3333333300000000  0.6666666700000000  0.6897683800000001
   0.6666666700000000  0.3333333300000000  0.1897683800000000
   0.2769263400000000  0.1378399800000000  0.6336218700000000
   0.8621600200000000  0.1390863700000000  0.6336218700000000
   0.8609136300000000  0.7230736600000001  0.6336218700000000
   0.7230736600000001  0.8621600200000000  0.1336218700000000
   0.1378399800000000  0.8609136300000000  0.1336218700000000
   0.1390863700000000  0.2769263400000000  0.1336218700000000
   0.3846045000000000  0.0793246000000000  0.7086108400000000
   0.9206754000000000  0.3052799000000000  0.7086108400000000
   0.6947201000000001  0.6153955000000000  0.7086108400000000
   0.6153955000000000  0.9206754000000000  0.2086108400000000
   0.0793246000000000  0.6947201000000001  0.2086108400000000
   0.3052799000000000  0.3846045000000000  0.2086108400000000