P   LATTICE,NONEQUIV.ATOMS   7   19 P212121                                    
MODE OF CALC=RELA unit=bohr                                                    
 12.812343 13.507762 34.922139 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.11370000 Y=0.57580000 Z=0.01770000
          MULT= 4          ISPLIT= 8
      -1: X=0.38630000 Y=0.42420000 Z=0.51770000
      -1: X=0.61370000 Y=0.92420000 Z=0.98230000
      -1: X=0.88630000 Y=0.07580000 Z=0.48230000
Cs         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  55.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.42730000 Y=0.25860000 Z=0.16400000
          MULT= 4          ISPLIT= 8
      -2: X=0.07270000 Y=0.74140000 Z=0.66400000
      -2: X=0.92730000 Y=0.24140000 Z=0.83600000
      -2: X=0.57270000 Y=0.75860000 Z=0.33600000
Cs         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  55.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.08300000 Y=0.07460000 Z=0.02900000
          MULT= 4          ISPLIT= 8
      -3: X=0.41700000 Y=0.92540000 Z=0.52900000
      -3: X=0.58300000 Y=0.42540000 Z=0.97100000
      -3: X=0.91700000 Y=0.57460000 Z=0.47100000
S          NPT=  781  R0=.000100000 RMT= 1.89        Z:  16.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.07280000 Y=0.62450000 Z=0.38050000
          MULT= 4          ISPLIT= 8
      -4: X=0.42720000 Y=0.37550000 Z=0.88050000
      -4: X=0.57280000 Y=0.87550000 Z=0.61950000
      -4: X=0.92720000 Y=0.12450000 Z=0.11950000
S          NPT=  781  R0=.000100000 RMT= 1.89        Z:  16.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.06210000 Y=0.40020000 Z=0.30910000
          MULT= 4          ISPLIT= 8
      -5: X=0.43790000 Y=0.59980000 Z=0.80910000
      -5: X=0.56210000 Y=0.09980000 Z=0.69090000
      -5: X=0.93790000 Y=0.90020000 Z=0.19090000
S          NPT=  781  R0=.000100000 RMT= 1.89        Z:  16.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.24140000 Y=0.19110000 Z=0.35020000
          MULT= 4          ISPLIT= 8
      -6: X=0.25860000 Y=0.80890000 Z=0.85020000
      -6: X=0.74140000 Y=0.30890000 Z=0.64980000
      -6: X=0.75860000 Y=0.69110000 Z=0.14980000
S          NPT=  781  R0=.000100000 RMT= 1.89        Z:  16.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -7: X=0.52930000 Y=0.26430000 Z=0.34610000
          MULT= 4          ISPLIT= 8
      -7: X=0.97070000 Y=0.73570000 Z=0.84610000
      -7: X=0.02930000 Y=0.23570000 Z=0.65390000
      -7: X=0.47070000 Y=0.76430000 Z=0.15390000
S          NPT=  781  R0=.000100000 RMT= 1.89        Z:  16.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000