CXY LATTICE,NONEQUIV.ATOMS   8   63 Cmcm                                       
MODE OF CALC=RELA unit=bohr                                                    
 21.420046 12.366368 16.648487 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.33300000 Y=0.00000000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -1: X=0.66700000 Y=0.00000000 Z=0.00000000
      -1: X=0.33300000 Y=0.00000000 Z=0.50000000
      -1: X=0.66700000 Y=0.00000000 Z=0.50000000
Y          NPT=  781  R0=.000010000 RMT= 2.29        Z:  39.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -2: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -2: X=0.00000000 Y=0.00000000 Z=0.50000000
Y          NPT=  781  R0=.000010000 RMT= 2.29        Z:  39.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -3: X=0.11900000 Y=0.21350000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -3: X=0.88100000 Y=0.78650000 Z=0.75000000
      -3: X=0.88100000 Y=0.21350000 Z=0.25000000
      -3: X=0.11900000 Y=0.78650000 Z=0.75000000
B          NPT=  781  R0=.000100000 RMT= 1.30        Z:   5.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.00000000 Y=0.57100000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -4: X=0.00000000 Y=0.42900000 Z=0.75000000
B          NPT=  781  R0=.000100000 RMT= 1.30        Z:   5.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -5: X=0.10900000 Y=0.44250000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -5: X=0.89100000 Y=0.55750000 Z=0.75000000
      -5: X=0.89100000 Y=0.44250000 Z=0.25000000
      -5: X=0.10900000 Y=0.55750000 Z=0.75000000
O          NPT=  781  R0=.000100000 RMT= 1.51        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  -6: X=0.00000000 Y=0.11450000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -6: X=0.00000000 Y=0.88550000 Z=0.75000000
O          NPT=  781  R0=.000100000 RMT= 1.51        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  -7: X=0.16700000 Y=0.16700000 Z=0.09500000
          MULT= 8          ISPLIT= 8
      -7: X=0.83300000 Y=0.83300000 Z=0.90500000
      -7: X=0.16700000 Y=0.16700000 Z=0.40500000
      -7: X=0.83300000 Y=0.83300000 Z=0.59500000
      -7: X=0.83300000 Y=0.16700000 Z=0.09500000
      -7: X=0.16700000 Y=0.83300000 Z=0.90500000
      -7: X=0.83300000 Y=0.16700000 Z=0.40500000
      -7: X=0.16700000 Y=0.83300000 Z=0.59500000
O          NPT=  781  R0=.000100000 RMT= 1.51        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  -8: X=0.00000000 Y=0.66700000 Z=0.09500000
          MULT= 4          ISPLIT= 8
      -8: X=0.00000000 Y=0.33300000 Z=0.90500000
      -8: X=0.00000000 Y=0.66700000 Z=0.40500000
      -8: X=0.00000000 Y=0.33300000 Z=0.59500000
O          NPT=  781  R0=.000100000 RMT= 1.51        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000