P   LATTICE,NONEQUIV.ATOMS   6  113 P-421m                                     
MODE OF CALC=RELA unit=bohr                                                    
 14.791453 14.791453  9.478677 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.16950000 Y=0.66950000 Z=0.50750000
          MULT= 4          ISPLIT= 8
      -1: X=0.66950000 Y=0.83050000 Z=0.49250000
      -1: X=0.83050000 Y=0.33050000 Z=0.50750000
      -1: X=0.33050000 Y=0.16950000 Z=0.49250000
Ca         NPT=  781  R0=.000050000 RMT= 2.24        Z:  20.00000              
LOCAL ROT MATRIX:    0.0000000-0.7071068-0.7071068
                     0.0000000-0.7071068 0.7071068
                    -1.0000000 0.0000000 0.0000000
ATOM  -2: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 2          ISPLIT=-2
      -2: X=0.50000000 Y=0.50000000 Z=0.00000000
Zn         NPT=  781  R0=.000050000 RMT= 1.94        Z:  30.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.63940000 Y=0.13940000 Z=0.93890000
          MULT= 4          ISPLIT= 8
      -3: X=0.13940000 Y=0.36060000 Z=0.06110000
      -3: X=0.36060000 Y=0.86060000 Z=0.93890000
      -3: X=0.86060000 Y=0.63940000 Z=0.06110000
Si         NPT=  781  R0=.000100000 RMT= 1.38        Z:  14.00000              
LOCAL ROT MATRIX:    0.0000000-0.7071068-0.7071068
                     0.0000000-0.7071068 0.7071068
                    -1.0000000 0.0000000 0.0000000
ATOM  -4: X=0.00000000 Y=0.50000000 Z=0.17430000
          MULT= 2          ISPLIT= 8
      -4: X=0.50000000 Y=0.00000000 Z=0.82570000
O          NPT=  781  R0=.000100000 RMT= 1.61        Z:   8.00000              
LOCAL ROT MATRIX:    0.7071068 0.7071068 0.0000000
                    -0.7071068 0.7071068 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.63840000 Y=0.13840000 Z=0.25630000
          MULT= 4          ISPLIT= 8
      -5: X=0.13840000 Y=0.36160000 Z=0.74370000
      -5: X=0.36160000 Y=0.86160000 Z=0.25630000
      -5: X=0.86160000 Y=0.63840000 Z=0.74370000
O          NPT=  781  R0=.000100000 RMT= 1.61        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000-0.7071068-0.7071068
                     0.0000000-0.7071068 0.7071068
                    -1.0000000 0.0000000 0.0000000
ATOM  -6: X=0.08660000 Y=0.18600000 Z=0.20980000
          MULT= 8          ISPLIT= 8
      -6: X=0.18600000 Y=0.91340000 Z=0.79020000
      -6: X=0.58660000 Y=0.31400000 Z=0.79020000
      -6: X=0.91340000 Y=0.81400000 Z=0.20980000
      -6: X=0.31400000 Y=0.41340000 Z=0.20980000
      -6: X=0.81400000 Y=0.08660000 Z=0.79020000
      -6: X=0.41340000 Y=0.68600000 Z=0.79020000
      -6: X=0.68600000 Y=0.58660000 Z=0.20980000
O          NPT=  781  R0=.000100000 RMT= 1.61        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000