CXY LATTICE,NONEQUIV.ATOMS   6   63 Cmcm    
MODE OF CALC=RELA unit=bohr
 21.032652 14.437130 14.626291 90.000000 90.000000 90.000000
ATOM  -1: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 2          ISPLIT=15
      -1: X=0.00000000 Y=0.00000000 Z=0.50000000
La         NPT=  781  R0=.000010000 RMT=   2.00000   Z:  57.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.22750000 Y=0.29720000 Z=0.25000000
          MULT= 4          ISPLIT=15
      -2: X=0.77250000 Y=0.70280000 Z=0.75000000
      -2: X=0.77250000 Y=0.29720000 Z=0.25000000
      -2: X=0.22750000 Y=0.70280000 Z=0.75000000
La         NPT=  781  R0=.000010000 RMT=   2.00000   Z:  57.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.00000000 Y=0.50000000 Z=0.00000000
          MULT= 2          ISPLIT=15
      -3: X=0.00000000 Y=0.50000000 Z=0.50000000
Sb         NPT=  781  R0=.000010000 RMT=   2.00000   Z:  51.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.37600000 Y=0.17400000 Z=0.03600000
          MULT= 8          ISPLIT=15
      -4: X=0.62400000 Y=0.82600000 Z=0.96400000
      -4: X=0.37600000 Y=0.17400000 Z=0.46400000
      -4: X=0.62400000 Y=0.82600000 Z=0.53600000
      -4: X=0.62400000 Y=0.17400000 Z=0.03600000
      -4: X=0.37600000 Y=0.82600000 Z=0.96400000
      -4: X=0.62400000 Y=0.17400000 Z=0.46400000
      -4: X=0.37600000 Y=0.82600000 Z=0.53600000
O          NPT=  781  R0=.000100000 RMT=   2.00000   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=0.13400000 Y=0.02300000 Z=0.25000000
          MULT= 4          ISPLIT=15
      -5: X=0.86600000 Y=0.97700000 Z=0.75000000
      -5: X=0.86600000 Y=0.02300000 Z=0.25000000
      -5: X=0.13400000 Y=0.97700000 Z=0.75000000
O          NPT=  781  R0=.000100000 RMT=   2.00000   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=0.43100000 Z=0.25000000
          MULT= 2          ISPLIT=15
      -6: X=0.00000000 Y=0.56900000 Z=0.75000000
O          NPT=  781  R0=.000100000 RMT=   2.00000   Z:   8.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000