P   LATTICE,NONEQUIV.ATOMS   6  137 P42/nmc                                    
MODE OF CALC=RELA unit=bohr                                                    
 18.380043 18.380043  8.787415 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.25000000 Y=0.58751000 Z=0.51690000
          MULT= 8          ISPLIT= 8
      -1: X=0.75000000 Y=0.41249000 Z=0.48310000
      -1: X=0.91249000 Y=0.25000000 Z=0.01690000
      -1: X=0.08751000 Y=0.75000000 Z=0.98310000
      -1: X=0.25000000 Y=0.91249000 Z=0.51690000
      -1: X=0.75000000 Y=0.08751000 Z=0.48310000
      -1: X=0.58751000 Y=0.25000000 Z=0.01690000
      -1: X=0.41249000 Y=0.75000000 Z=0.98310000
Zn         NPT=  781  R0=.000050000 RMT= 2.02        Z:  30.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -2: X=0.25000000 Y=0.09530000 Z=0.31770000
          MULT= 8          ISPLIT= 8
      -2: X=0.75000000 Y=0.90470000 Z=0.68230000
      -2: X=0.40470000 Y=0.25000000 Z=0.81770000
      -2: X=0.59530000 Y=0.75000000 Z=0.18230000
      -2: X=0.25000000 Y=0.40470000 Z=0.31770000
      -2: X=0.75000000 Y=0.59530000 Z=0.68230000
      -2: X=0.09530000 Y=0.25000000 Z=0.81770000
      -2: X=0.90470000 Y=0.75000000 Z=0.18230000
O          NPT=  781  R0=.000100000 RMT= 1.74        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -3: X=0.75000000 Y=0.25000000 Z=0.75000000
          MULT= 2          ISPLIT=-2
      -3: X=0.25000000 Y=0.75000000 Z=0.25000000
O          NPT=  781  R0=.000100000 RMT= 1.74        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  -4: X=0.57650000 Y=0.42350000 Z=0.25000000
          MULT= 8          ISPLIT= 8
      -4: X=0.42350000 Y=0.57650000 Z=0.75000000
      -4: X=0.07650000 Y=0.57650000 Z=0.75000000
      -4: X=0.92350000 Y=0.42350000 Z=0.25000000
      -4: X=0.92350000 Y=0.07650000 Z=0.25000000
      -4: X=0.07650000 Y=0.92350000 Z=0.75000000
      -4: X=0.42350000 Y=0.92350000 Z=0.75000000
      -4: X=0.57650000 Y=0.07650000 Z=0.25000000
O          NPT=  781  R0=.000100000 RMT= 1.74        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  -5: X=0.25000000 Y=0.25000000 Z=0.08700000
          MULT= 4          ISPLIT= 8
      -5: X=0.75000000 Y=0.75000000 Z=0.91300000
      -5: X=0.25000000 Y=0.25000000 Z=0.58700000
      -5: X=0.75000000 Y=0.75000000 Z=0.41300000
Li         NPT=  781  R0=.000100000 RMT= 1.56        Z:   3.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.11030000 Y=0.06520000 Z=0.03000000
          MULT=16          ISPLIT= 8
      -6: X=0.88970000 Y=0.93480000 Z=0.97000000
      -6: X=0.43480000 Y=0.11030000 Z=0.53000000
      -6: X=0.56520000 Y=0.88970000 Z=0.47000000
      -6: X=0.38970000 Y=0.06520000 Z=0.03000000
      -6: X=0.61030000 Y=0.93480000 Z=0.97000000
      -6: X=0.38970000 Y=0.43480000 Z=0.03000000
      -6: X=0.61030000 Y=0.56520000 Z=0.97000000
      -6: X=0.43480000 Y=0.38970000 Z=0.53000000
      -6: X=0.56520000 Y=0.61030000 Z=0.47000000
      -6: X=0.06520000 Y=0.38970000 Z=0.53000000
      -6: X=0.93480000 Y=0.61030000 Z=0.47000000
      -6: X=0.11030000 Y=0.43480000 Z=0.03000000
      -6: X=0.88970000 Y=0.56520000 Z=0.97000000
      -6: X=0.06520000 Y=0.11030000 Z=0.53000000
      -6: X=0.93480000 Y=0.88970000 Z=0.47000000
Li         NPT=  781  R0=.000100000 RMT= 1.56        Z:   3.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000