P   LATTICE,NONEQUIV.ATOMS   5   19 P212121                                    
MODE OF CALC=RELA unit=bohr                                                    
  8.870563 11.460244 25.000132 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.32320000 Y=0.29990000 Z=0.07800000
          MULT= 4          ISPLIT= 8
      -1: X=0.17680000 Y=0.70010000 Z=0.57800000
      -1: X=0.82320000 Y=0.20010000 Z=0.92200000
      -1: X=0.67680000 Y=0.79990000 Z=0.42200000
As         NPT=  781  R0=.000050000 RMT= 1.57        Z:  33.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.22190000 Y=0.09920000 Z=0.14920000
          MULT= 4          ISPLIT= 8
      -2: X=0.27810000 Y=0.90080000 Z=0.64920000
      -2: X=0.72190000 Y=0.40080000 Z=0.85080000
      -2: X=0.77810000 Y=0.59920000 Z=0.35080000
O          NPT=  781  R0=.000100000 RMT= 1.42        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  -3: X=0.32000000 Y=0.55310000 Z=0.11050000
          MULT= 4          ISPLIT= 8
      -3: X=0.18000000 Y=0.44690000 Z=0.61050000
      -3: X=0.82000000 Y=0.94690000 Z=0.88950000
      -3: X=0.68000000 Y=0.05310000 Z=0.38950000
O          NPT=  781  R0=.000100000 RMT= 1.42        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=0.64130000 Y=0.21060000 Z=0.03480000
          MULT= 4          ISPLIT= 8
      -4: X=0.85870000 Y=0.78940000 Z=0.53480000
      -4: X=0.14130000 Y=0.28940000 Z=0.96520000
      -4: X=0.35870000 Y=0.71060000 Z=0.46520000
O          NPT=  781  R0=.000100000 RMT= 1.42        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=0.20600000 Y=0.27340000 Z=0.35970000
          MULT= 4          ISPLIT= 8
      -5: X=0.29400000 Y=0.72660000 Z=0.85970000
      -5: X=0.70600000 Y=0.22660000 Z=0.64030000
      -5: X=0.79400000 Y=0.77340000 Z=0.14030000
K          NPT=  781  R0=.000050000 RMT= 2.47        Z:  19.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000