P   LATTICE,NONEQUIV.ATOMS   9   55 Pbam    
MODE OF CALC=RELA unit=bohr
 17.338237 21.826337  6.940964 90.000000 90.000000 90.000000
ATOM  -1: X=0.32300000 Y=0.41300000 Z=0.50000000
          MULT= 4          ISPLIT=15
      -1: X=0.67700000 Y=0.58700000 Z=0.50000000
      -1: X=0.17700000 Y=0.91300000 Z=0.50000000
      -1: X=0.82300000 Y=0.08700000 Z=0.50000000
Y          NPT=  781  R0=.000010000 RMT=   2.00000   Z:  39.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.44500000 Y=0.13100000 Z=0.50000000
          MULT= 4          ISPLIT=15
      -2: X=0.55500000 Y=0.86900000 Z=0.50000000
      -2: X=0.05500000 Y=0.63100000 Z=0.50000000
      -2: X=0.94500000 Y=0.36900000 Z=0.50000000
Y          NPT=  781  R0=.000010000 RMT=   2.00000   Z:  39.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.13800000 Y=0.17800000 Z=0.50000000
          MULT= 4          ISPLIT=15
      -3: X=0.86200000 Y=0.82200000 Z=0.50000000
      -3: X=0.36200000 Y=0.67800000 Z=0.50000000
      -3: X=0.63800000 Y=0.32200000 Z=0.50000000
Re         NPT=  781  R0=.000005000 RMT=   2.00000   Z:  75.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.05000000 Y=0.06000000 Z=0.00000000
          MULT= 4          ISPLIT=15
      -4: X=0.95000000 Y=0.94000000 Z=0.00000000
      -4: X=0.45000000 Y=0.56000000 Z=0.00000000
      -4: X=0.55000000 Y=0.44000000 Z=0.00000000
B          NPT=  781  R0=.000100000 RMT=   2.00000   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  -5: X=0.25000000 Y=0.07500000 Z=0.00000000
          MULT= 4          ISPLIT=15
      -5: X=0.75000000 Y=0.92500000 Z=0.00000000
      -5: X=0.25000000 Y=0.57500000 Z=0.00000000
      -5: X=0.75000000 Y=0.42500000 Z=0.00000000
B          NPT=  781  R0=.000100000 RMT=   2.00000   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  -6: X=0.30000000 Y=0.24000000 Z=0.00000000
          MULT= 4          ISPLIT=15
      -6: X=0.70000000 Y=0.76000000 Z=0.00000000
      -6: X=0.20000000 Y=0.74000000 Z=0.00000000
      -6: X=0.80000000 Y=0.26000000 Z=0.00000000
B          NPT=  781  R0=.000100000 RMT=   2.00000   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  -7: X=0.14000000 Y=0.31000000 Z=0.00000000
          MULT= 4          ISPLIT=15
      -7: X=0.86000000 Y=0.69000000 Z=0.00000000
      -7: X=0.36000000 Y=0.81000000 Z=0.00000000
      -7: X=0.64000000 Y=0.19000000 Z=0.00000000
B          NPT=  781  R0=.000100000 RMT=   2.00000   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  -8: X=0.48000000 Y=0.29000000 Z=0.00000000
          MULT= 4          ISPLIT=15
      -8: X=0.52000000 Y=0.71000000 Z=0.00000000
      -8: X=0.02000000 Y=0.79000000 Z=0.00000000
      -8: X=0.98000000 Y=0.21000000 Z=0.00000000
B          NPT=  781  R0=.000100000 RMT=   2.00000   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  -9: X=0.11000000 Y=0.47000000 Z=0.00000000
          MULT= 4          ISPLIT=15
      -9: X=0.89000000 Y=0.53000000 Z=0.00000000
      -9: X=0.39000000 Y=0.97000000 Z=0.00000000
      -9: X=0.61000000 Y=0.03000000 Z=0.00000000
B          NPT=  781  R0=.000100000 RMT=   2.00000   Z:   5.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000