CXY LATTICE,NONEQUIV.ATOMS   6   63 Cmcm                                       
MODE OF CALC=RELA unit=bohr                                                    
 20.503529 12.262433  9.775553 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.76601000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -1: X=0.00000000 Y=0.23399000 Z=0.75000000
Zn         NPT=  781  R0=.000050000 RMT= 2.04        Z:  30.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -2: X=0.00000000 Y=0.07740000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -2: X=0.00000000 Y=0.92260000 Z=0.75000000
O          NPT=  781  R0=.000100000 RMT= 1.45        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.22000000 Y=0.02350000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -3: X=0.78000000 Y=0.97650000 Z=0.75000000
      -3: X=0.78000000 Y=0.02350000 Z=0.25000000
      -3: X=0.22000000 Y=0.97650000 Z=0.75000000
O          NPT=  781  R0=.000100000 RMT= 1.45        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.12769000 Y=0.31670000 Z=0.02150000
          MULT= 8          ISPLIT= 8
      -4: X=0.87231000 Y=0.68330000 Z=0.97850000
      -4: X=0.12769000 Y=0.31670000 Z=0.47850000
      -4: X=0.87231000 Y=0.68330000 Z=0.52150000
      -4: X=0.87231000 Y=0.31670000 Z=0.02150000
      -4: X=0.12769000 Y=0.68330000 Z=0.97850000
      -4: X=0.87231000 Y=0.31670000 Z=0.47850000
      -4: X=0.12769000 Y=0.68330000 Z=0.52150000
O          NPT=  781  R0=.000100000 RMT= 1.45        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.29740000 Y=0.00000000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -5: X=0.70260000 Y=0.00000000 Z=0.00000000
      -5: X=0.29740000 Y=0.00000000 Z=0.50000000
      -5: X=0.70260000 Y=0.00000000 Z=0.50000000
B          NPT=  781  R0=.000100000 RMT= 1.25        Z:   5.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -6: X=0.11740000 Y=0.19220000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -6: X=0.88260000 Y=0.80780000 Z=0.75000000
      -6: X=0.88260000 Y=0.19220000 Z=0.25000000
      -6: X=0.11740000 Y=0.80780000 Z=0.75000000
B          NPT=  781  R0=.000100000 RMT= 1.25        Z:   5.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000