CXZ LATTICE,NONEQUIV.ATOMS   6    5 B2                                         
MODE OF CALC=RELA unit=bohr                                                    
 13.447291 12.298338  9.435403 90.000000 90.000000 74.380000                   
ATOM  -1: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 1          ISPLIT= 8
Bi         NPT=  781  R0=.000005000 RMT= 2.16        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=0.00000000 Y=0.50000000 Z=0.29100000
          MULT= 1          ISPLIT= 8
B          NPT=  781  R0=.000100000 RMT= 1.16        Z:   5.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.75200000 Y=0.30600000 Z=0.44400000
          MULT= 2          ISPLIT= 8
      -3: X=0.24800000 Y=0.69400000 Z=0.44400000
B          NPT=  781  R0=.000100000 RMT= 1.16        Z:   5.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.85400000 Y=0.45100000 Z=0.45900000
          MULT= 2          ISPLIT= 8
      -4: X=0.14600000 Y=0.54900000 Z=0.45900000
O          NPT=  781  R0=.000100000 RMT= 1.35        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  -5: X=0.90800000 Y=0.68400000 Z=0.11500000
          MULT= 2          ISPLIT= 8
      -5: X=0.09200000 Y=0.31600000 Z=0.11500000
O          NPT=  781  R0=.000100000 RMT= 1.35        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  -6: X=0.79200000 Y=0.12400000 Z=0.29400000
          MULT= 2          ISPLIT= 8
      -6: X=0.20800000 Y=0.87600000 Z=0.29400000
O          NPT=  781  R0=.000100000 RMT= 1.35        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000