P   LATTICE,NONEQUIV.ATOMS   7   19 P212121                                    
MODE OF CALC=RELA unit=bohr                                                    
 12.271882 12.472192 32.907691 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.12480000 Y=0.58450000 Z=0.01270000
          MULT= 4          ISPLIT= 8
      -1: X=0.37520000 Y=0.41550000 Z=0.51270000
      -1: X=0.62480000 Y=0.91550000 Z=0.98730000
      -1: X=0.87520000 Y=0.08450000 Z=0.48730000
K          NPT=  781  R0=.000050000 RMT= 2.50000     Z:  19.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.42010000 Y=0.23730000 Z=0.16490000
          MULT= 4          ISPLIT= 8
      -2: X=0.07990000 Y=0.76270000 Z=0.66490000
      -2: X=0.92010000 Y=0.26270000 Z=0.83510000
      -2: X=0.57990000 Y=0.73730000 Z=0.33510000
K          NPT=  781  R0=.000050000 RMT= 2.50000     Z:  19.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.08740000 Y=0.08480000 Z=0.02840000
          MULT= 4          ISPLIT= 8
      -3: X=0.41260000 Y=0.91520000 Z=0.52840000
      -3: X=0.58740000 Y=0.41520000 Z=0.97160000
      -3: X=0.91260000 Y=0.58480000 Z=0.47160000
S          NPT=  781  R0=.000100000 RMT= 1.91        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=0.07530000 Y=0.63070000 Z=0.37320000
          MULT= 4          ISPLIT= 8
      -4: X=0.42470000 Y=0.36930000 Z=0.87320000
      -4: X=0.57530000 Y=0.86930000 Z=0.62680000
      -4: X=0.92470000 Y=0.13070000 Z=0.12680000
S          NPT=  781  R0=.000100000 RMT= 1.91        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=0.05340000 Y=0.37650000 Z=0.30360000
          MULT= 4          ISPLIT= 8
      -5: X=0.44660000 Y=0.62350000 Z=0.80360000
      -5: X=0.55340000 Y=0.12350000 Z=0.69640000
      -5: X=0.94660000 Y=0.87650000 Z=0.19640000
S          NPT=  781  R0=.000100000 RMT= 1.91        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=0.23620000 Y=0.15570000 Z=0.35400000
          MULT= 4          ISPLIT= 8
      -6: X=0.26380000 Y=0.84430000 Z=0.85400000
      -6: X=0.73620000 Y=0.34430000 Z=0.64600000
      -6: X=0.76380000 Y=0.65570000 Z=0.14600000
S          NPT=  781  R0=.000100000 RMT= 1.91        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=0.53870000 Y=0.24060000 Z=0.34420000
          MULT= 4          ISPLIT= 8
      -7: X=0.96130000 Y=0.75940000 Z=0.84420000
      -7: X=0.03870000 Y=0.25940000 Z=0.65580000
      -7: X=0.46130000 Y=0.74060000 Z=0.15580000
S          NPT=  781  R0=.000100000 RMT= 1.91        Z:  16.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000