 O Se Nd
   1.0
     3.9657817400000002    0.0000000000000000    0.0000000000000000
    -1.9828908700000001    3.4344677300000002    0.0000000000000000
     0.0000000000000000    0.0000000000000000    6.9760721700000001
 O Se Nd
   2   1   2
Direct
   0.6666666700000000  0.3333333300000000  0.3739966200000000
   0.3333333300000000  0.6666666700000000  0.6260033800000000
   0.0000000000000000  0.0000000000000000  0.0000000000000000
   0.6666666700000000  0.3333333300000000  0.7118934200000000
   0.3333333300000000  0.6666666700000000  0.2881065800000000