Mo S 
 1.0000000000000000
     3.2467174154469256    0.0000000776430688    0.0000000000000000
    -1.6233586411995033    2.8117397996168290    0.0000000000000000
     0.0000000000000000    0.0000000000000000   23.1200000000000010
 Mo  S  
   1   2
Direct
  0.9999999998368796  0.9999999987702611  0.4999999998810176
  0.6666666634277522  0.3333333309185883  0.5674602213044606
  0.6666666700686972  0.3333333369778219  0.4325397788145219
Cartesian
  0.0000000000000000  0.0000000000000000  0.0000000000000000
  0.0000000000000000  0.0000000000000000  0.0000000000000000
  0.0000000000000000  0.0000000000000000  0.0000000000000000
