Mn1 O2                                  
   1.00000000000000     
     5.1560624464295026   -0.4685138753600430   -0.2774908296347530
     4.5934174723068821    2.3885168921144340   -0.2774907831218592
     4.5934174787321735    0.9046008812478271    2.2279385402490099
   Mn   O 
     1     2
Direct
  0.0015460395960755  0.0015460395947100  0.0015460395946786
  0.6029359506275096  0.6029359505910518  0.6029359505902148
  0.4001410097764171  0.4001410098142404  0.4001410098151089
 
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
