P   LATTICE,NONEQUIV.ATOMS   6   55 Pbam    
MODE OF CALC=RELA unit=bohr
 18.763091 22.115465 11.415836 90.000000 90.000000 90.000000
ATOM  -1: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 2          ISPLIT=15
      -1: X=0.50000000 Y=0.50000000 Z=0.00000000
Cd         NPT=  781  R0=.000010000 RMT=   2.00000   Z:  48.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.09420000 Y=0.25100000 Z=0.00000000
          MULT= 4          ISPLIT=15
      -2: X=0.90580000 Y=0.74900000 Z=0.00000000
      -2: X=0.40580000 Y=0.75100000 Z=0.00000000
      -2: X=0.59420000 Y=0.24900000 Z=0.00000000
Cd         NPT=  781  R0=.000010000 RMT=   2.00000   Z:  48.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.34160000 Y=0.31700000 Z=0.25660000
          MULT= 8          ISPLIT=15
      -3: X=0.65840000 Y=0.68300000 Z=0.74340000
      -3: X=0.34160000 Y=0.31700000 Z=0.74340000
      -3: X=0.65840000 Y=0.68300000 Z=0.25660000
      -3: X=0.15840000 Y=0.81700000 Z=0.25660000
      -3: X=0.84160000 Y=0.18300000 Z=0.74340000
      -3: X=0.15840000 Y=0.81700000 Z=0.74340000
      -3: X=0.84160000 Y=0.18300000 Z=0.25660000
Cd         NPT=  781  R0=.000010000 RMT=   2.00000   Z:  48.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.34130000 Y=0.04530000 Z=0.00000000
          MULT= 4          ISPLIT=15
      -4: X=0.65870000 Y=0.95470000 Z=0.00000000
      -4: X=0.15870000 Y=0.54530000 Z=0.00000000
      -4: X=0.84130000 Y=0.45470000 Z=0.00000000
Th         NPT=  781  R0=.000005000 RMT=   2.00000   Z:  90.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.16220000 Y=0.08350000 Z=0.50000000
          MULT= 4          ISPLIT=15
      -5: X=0.83780000 Y=0.91650000 Z=0.50000000
      -5: X=0.33780000 Y=0.58350000 Z=0.50000000
      -5: X=0.66220000 Y=0.41650000 Z=0.50000000
Th         NPT=  781  R0=.000005000 RMT=   2.00000   Z:  90.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.04770000 Y=0.37030000 Z=0.50000000
          MULT= 4          ISPLIT=15
      -6: X=0.95230000 Y=0.62970000 Z=0.50000000
      -6: X=0.45230000 Y=0.87030000 Z=0.50000000
      -6: X=0.54770000 Y=0.12970000 Z=0.50000000
Th         NPT=  781  R0=.000005000 RMT=   2.00000   Z:  90.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000