P   LATTICE,NONEQUIV.ATOMS   3   58 Pnnm                                       
MODE OF CALC=RELA unit=bohr                                                    
  7.320799 22.517977  7.256548 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.08060000 Y=0.35677000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -1: X=0.91940000 Y=0.64323000 Z=0.00000000
      -1: X=0.41940000 Y=0.85677000 Z=0.50000000
      -1: X=0.58060000 Y=0.14323000 Z=0.50000000
Bi         NPT=  781  R0=.000005000 RMT= 2.32        Z:  83.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.55780000 Y=0.25030000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -2: X=0.44220000 Y=0.74970000 Z=0.00000000
      -2: X=0.94220000 Y=0.75030000 Z=0.50000000
      -2: X=0.05780000 Y=0.24970000 Z=0.50000000
O          NPT=  781  R0=.000100000 RMT= 1.90        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -3: X=0.50000000 Y=0.50000000 Z=0.50000000
S          NPT=  781  R0=.000100000 RMT= 2.50        Z:  16.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000