P   LATTICE,NONEQUIV.ATOMS   6   19 P212121                                    
MODE OF CALC=RELA unit=bohr                                                    
  9.533290 12.207064 29.458941 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.36399000 Y=0.33367000 Z=0.14967000
          MULT= 4          ISPLIT= 8
      -1: X=0.13601000 Y=0.66633000 Z=0.64967000
      -1: X=0.86399000 Y=0.16633000 Z=0.85033000
      -1: X=0.63601000 Y=0.83367000 Z=0.35033000
Se         NPT=  781  R0=.000050000 RMT= 1.92        Z:  34.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.04310000 Y=0.64030000 Z=0.23410000
          MULT= 4          ISPLIT= 8
      -2: X=0.45690000 Y=0.35970000 Z=0.73410000
      -2: X=0.54310000 Y=0.85970000 Z=0.76590000
      -2: X=0.95690000 Y=0.14030000 Z=0.26590000
N          NPT=  781  R0=.000100000 RMT= 1.10        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=0.11630000 Y=0.20750000 Z=0.22170000
          MULT= 4          ISPLIT= 8
      -3: X=0.38370000 Y=0.79250000 Z=0.72170000
      -3: X=0.61630000 Y=0.29250000 Z=0.77830000
      -3: X=0.88370000 Y=0.70750000 Z=0.27830000
C          NPT=  781  R0=.000100000 RMT= 1.05        Z:   6.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.57558000 Y=0.02354000 Z=0.10925000
          MULT= 4          ISPLIT= 8
      -4: X=0.92442000 Y=0.97646000 Z=0.60925000
      -4: X=0.07558000 Y=0.47646000 Z=0.89075000
      -4: X=0.42442000 Y=0.52354000 Z=0.39075000
Se         NPT=  781  R0=.000050000 RMT= 1.92        Z:  34.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.28690000 Y=0.07860000 Z=0.46180000
          MULT= 4          ISPLIT= 8
      -5: X=0.21310000 Y=0.92140000 Z=0.96180000
      -5: X=0.78690000 Y=0.42140000 Z=0.53820000
      -5: X=0.71310000 Y=0.57860000 Z=0.03820000
N          NPT=  781  R0=.000100000 RMT= 1.10        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  -6: X=0.15040000 Y=0.03710000 Z=0.51880000
          MULT= 4          ISPLIT= 8
      -6: X=0.34960000 Y=0.96290000 Z=0.01880000
      -6: X=0.65040000 Y=0.46290000 Z=0.48120000
      -6: X=0.84960000 Y=0.53710000 Z=0.98120000
C          NPT=  781  R0=.000100000 RMT= 1.05        Z:   6.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000