P   LATTICE,NONEQUIV.ATOMS   5   19 P212121                                    
MODE OF CALC=RELA unit=bohr                                                    
  7.619376 12.942734 22.703170 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.22624000 Y=0.04063000 Z=0.26483000
          MULT= 4          ISPLIT= 8
      -1: X=0.27376000 Y=0.95937000 Z=0.76483000
      -1: X=0.72624000 Y=0.45937000 Z=0.73517000
      -1: X=0.77376000 Y=0.54063000 Z=0.23517000
Br         NPT=  781  R0=.000050000 RMT= 1.83        Z:  35.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.15950000 Y=0.01520000 Z=0.03720000
          MULT= 4          ISPLIT= 8
      -2: X=0.34050000 Y=0.98480000 Z=0.53720000
      -2: X=0.65950000 Y=0.48480000 Z=0.96280000
      -2: X=0.84050000 Y=0.51520000 Z=0.46280000
N          NPT=  781  R0=.000100000 RMT= 1.09        Z:   7.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.02920000 Y=0.11330000 Z=0.13110000
          MULT= 4          ISPLIT= 8
      -3: X=0.47080000 Y=0.88670000 Z=0.63110000
      -3: X=0.52920000 Y=0.38670000 Z=0.86890000
      -3: X=0.97080000 Y=0.61330000 Z=0.36890000
O          NPT=  781  R0=.000100000 RMT= 1.15        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=0.52220000 Y=0.42880000 Z=0.04670000
          MULT= 4          ISPLIT= 8
      -4: X=0.97780000 Y=0.57120000 Z=0.54670000
      -4: X=0.02220000 Y=0.07120000 Z=0.95330000
      -4: X=0.47780000 Y=0.92880000 Z=0.45330000
O          NPT=  781  R0=.000100000 RMT= 1.15        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=0.12750000 Y=0.10380000 Z=0.54880000
          MULT= 4          ISPLIT= 8
      -5: X=0.37250000 Y=0.89620000 Z=0.04880000
      -5: X=0.62750000 Y=0.39620000 Z=0.45120000
      -5: X=0.87250000 Y=0.60380000 Z=0.95120000
O          NPT=  781  R0=.000100000 RMT= 1.15        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000