Mo 
 1.0000000000000000
     2.7314073010746083    0.0000000000000000   -0.0000000000000000
    -1.3657036505373041    2.3654681108129023    0.0000000000000000
     0.0000000000000000    0.0000000000000000    2.5426022461658500
 Mo 
   1
Selective dynamics
Cartesian
  0.0000000000000000  0.0000000000000000  0.0000000000000000   T   T   T