 Nd H O
   1.0
     6.3828259699999998    0.0000000000000000   -0.0494886400000000
     0.0000000000000000    3.6787594200000000    0.0000000000000000
    -3.1485041900000001    0.0000000000000000    5.5524861400000001
 Nd H O
   2   6   6
Direct
   0.3333299200000000  0.7500000000000000  0.6666680300000001
   0.6666700800000001  0.2500000000000000  0.3333319700000000
   0.2766021300000000  0.7500000000000000  0.1348206100000000
   0.8582079600000000  0.7500000000000000  0.7233959200000000
   0.8651818200000000  0.7500000000000000  0.1417578300000000
   0.7233978700000000  0.2500000000000000  0.8651793900000000
   0.1417920400000000  0.2500000000000000  0.2766040800000000
   0.1348181800000000  0.2500000000000000  0.8582421700000000
   0.3904165500000000  0.7500000000000000  0.3091079800000000
   0.9186887500000001  0.7500000000000000  0.6095862599999999
   0.6908969500000000  0.7500000000000000  0.0813020800000000
   0.6095834500000000  0.2500000000000000  0.6908920199999999
   0.0813112500000000  0.2500000000000000  0.3904137400000000
   0.3091030500000000  0.2500000000000000  0.9186979200000001