P   LATTICE,NONEQUIV.ATOMS   5  198 P213                                       
MODE OF CALC=RELA unit=bohr                                                    
 16.544174 16.544174 16.544174 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.26717000 Y=0.26717000 Z=0.26717000
          MULT= 4          ISPLIT= 4
      -1: X=0.23283000 Y=0.73283000 Z=0.76717000
      -1: X=0.76717000 Y=0.23283000 Z=0.73283000
      -1: X=0.73283000 Y=0.76717000 Z=0.23283000
Bi         NPT=  781  R0=.000005000 RMT= 2.12        Z:  83.00000              
LOCAL ROT MATRIX:    0.7071068 0.4082483 0.5773503
                    -0.7071068 0.4082483 0.5773503
                     0.0000000-0.8164966 0.5773503
ATOM  -2: X=0.77737000 Y=0.77737000 Z=0.77737000
          MULT= 4          ISPLIT= 4
      -2: X=0.72263000 Y=0.22263000 Z=0.27737000
      -2: X=0.27737000 Y=0.72263000 Z=0.22263000
      -2: X=0.22263000 Y=0.27737000 Z=0.72263000
Rb         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  37.00000              
LOCAL ROT MATRIX:    0.7071068 0.4082483 0.5773503
                    -0.7071068 0.4082483 0.5773503
                     0.0000000-0.8164966 0.5773503
ATOM  -3: X=0.54112000 Y=0.54112000 Z=0.54112000
          MULT= 4          ISPLIT= 4
      -3: X=0.95888000 Y=0.45888000 Z=0.04112000
      -3: X=0.04112000 Y=0.95888000 Z=0.45888000
      -3: X=0.45888000 Y=0.04112000 Z=0.95888000
Rb         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  37.00000              
LOCAL ROT MATRIX:    0.7071068 0.4082483 0.5773503
                    -0.7071068 0.4082483 0.5773503
                     0.0000000-0.8164966 0.5773503
ATOM  -4: X=0.03605000 Y=0.03605000 Z=0.03605000
          MULT= 4          ISPLIT= 4
      -4: X=0.46395000 Y=0.96395000 Z=0.53605000
      -4: X=0.53605000 Y=0.46395000 Z=0.96395000
      -4: X=0.96395000 Y=0.53605000 Z=0.46395000
Rb         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  37.00000              
LOCAL ROT MATRIX:    0.7071068 0.4082483 0.5773503
                    -0.7071068 0.4082483 0.5773503
                     0.0000000-0.8164966 0.5773503
ATOM  -5: X=0.03770000 Y=0.25360000 Z=0.31290000
          MULT=12          ISPLIT= 8
      -5: X=0.46230000 Y=0.74640000 Z=0.81290000
      -5: X=0.53770000 Y=0.24640000 Z=0.68710000
      -5: X=0.31290000 Y=0.03770000 Z=0.25360000
      -5: X=0.96230000 Y=0.75360000 Z=0.18710000
      -5: X=0.18710000 Y=0.96230000 Z=0.75360000
      -5: X=0.81290000 Y=0.46230000 Z=0.74640000
      -5: X=0.68710000 Y=0.53770000 Z=0.24640000
      -5: X=0.25360000 Y=0.31290000 Z=0.03770000
      -5: X=0.24640000 Y=0.68710000 Z=0.53770000
      -5: X=0.75360000 Y=0.18710000 Z=0.96230000
      -5: X=0.74640000 Y=0.81290000 Z=0.46230000
O          NPT=  781  R0=.000100000 RMT= 1.73        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000