P   LATTICE,NONEQUIV.ATOMS   5   14 P21/n                                      
MODE OF CALC=RELA unit=bohr                                                    
 15.777323 12.443847  9.499653 90.000000 90.000000108.910000                   
ATOM  -1: X=0.12288000 Y=0.74287000 Z=0.23409000
          MULT= 4          ISPLIT= 8
      -1: X=0.87712000 Y=0.25713000 Z=0.76591000
      -1: X=0.37712000 Y=0.75713000 Z=0.73409000
      -1: X=0.62288000 Y=0.24287000 Z=0.26591000
Bi         NPT=  781  R0=.000005000 RMT= 2.22        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=0.10920000 Y=0.20800000 Z=0.25270000
          MULT= 4          ISPLIT= 8
      -2: X=0.89080000 Y=0.79200000 Z=0.74730000
      -2: X=0.39080000 Y=0.29200000 Z=0.75270000
      -2: X=0.60920000 Y=0.70800000 Z=0.24730000
B          NPT=  781  R0=.000100000 RMT= 1.19        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=0.16980000 Y=0.06930000 Z=0.11030000
          MULT= 4          ISPLIT= 8
      -3: X=0.83020000 Y=0.93070000 Z=0.88970000
      -3: X=0.33020000 Y=0.43070000 Z=0.61030000
      -3: X=0.66980000 Y=0.56930000 Z=0.38970000
O          NPT=  781  R0=.000100000 RMT= 1.38        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  -4: X=0.02990000 Y=0.33340000 Z=0.12900000
          MULT= 4          ISPLIT= 8
      -4: X=0.97010000 Y=0.66660000 Z=0.87100000
      -4: X=0.47010000 Y=0.16660000 Z=0.62900000
      -4: X=0.52990000 Y=0.83340000 Z=0.37100000
O          NPT=  781  R0=.000100000 RMT= 1.38        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=0.14300000 Y=0.24390000 Z=0.52140000
          MULT= 4          ISPLIT= 8
      -5: X=0.85700000 Y=0.75610000 Z=0.47860000
      -5: X=0.35700000 Y=0.25610000 Z=0.02140000
      -5: X=0.64300000 Y=0.74390000 Z=0.97860000
O          NPT=  781  R0=.000100000 RMT= 1.38        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000