CXY LATTICE,NONEQUIV.ATOMS  10   63 Cmcm    
MODE OF CALC=RELA unit=bohr
 19.834566 28.175817 22.971511 90.000000 90.000000 90.000000
ATOM  -1: X=0.00000000 Y=0.74700000 Z=0.25000000
          MULT= 2          ISPLIT=15
      -1: X=0.00000000 Y=0.25300000 Z=0.75000000
Rb         NPT=  781  R0=.000010000 RMT=   2.00000   Z:  37.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.25060000 Y=0.00000000 Z=0.00000000
          MULT= 4          ISPLIT=15
      -2: X=0.74940000 Y=0.00000000 Z=0.00000000
      -2: X=0.25060000 Y=0.00000000 Z=0.50000000
      -2: X=0.74940000 Y=0.00000000 Z=0.50000000
Rb         NPT=  781  R0=.000010000 RMT=   2.00000   Z:  37.00000
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=0.35350000 Z=0.25000000
          MULT= 2          ISPLIT=15
      -3: X=0.00000000 Y=0.64650000 Z=0.75000000
Re         NPT=  781  R0=.000005000 RMT=   2.00000   Z:  75.00000
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=0.20980000 Z=0.14860000
          MULT= 4          ISPLIT=15
      -4: X=0.00000000 Y=0.79020000 Z=0.85140000
      -4: X=0.00000000 Y=0.20980000 Z=0.35140000
      -4: X=0.00000000 Y=0.79020000 Z=0.64860000
Re         NPT=  781  R0=.000005000 RMT=   2.00000   Z:  75.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.21710000 Y=0.19540000 Z=0.12110000
          MULT= 8          ISPLIT=15
      -5: X=0.78290000 Y=0.80460000 Z=0.87890000
      -5: X=0.21710000 Y=0.19540000 Z=0.37890000
      -5: X=0.78290000 Y=0.80460000 Z=0.62110000
      -5: X=0.78290000 Y=0.19540000 Z=0.12110000
      -5: X=0.21710000 Y=0.80460000 Z=0.87890000
      -5: X=0.78290000 Y=0.19540000 Z=0.37890000
      -5: X=0.21710000 Y=0.80460000 Z=0.62110000
Cl         NPT=  781  R0=.000100000 RMT=   2.00000   Z:  17.00000
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=0.12540000 Z=0.53530000
          MULT= 4          ISPLIT=15
      -6: X=0.00000000 Y=0.87460000 Z=0.46470000
      -6: X=0.00000000 Y=0.12540000 Z=0.96470000
      -6: X=0.00000000 Y=0.87460000 Z=0.03530000
Cl         NPT=  781  R0=.000100000 RMT=   2.00000   Z:  17.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -7: X=0.21750000 Y=0.38230000 Z=0.25000000
          MULT= 4          ISPLIT=15
      -7: X=0.78250000 Y=0.61770000 Z=0.75000000
      -7: X=0.78250000 Y=0.38230000 Z=0.25000000
      -7: X=0.21750000 Y=0.61770000 Z=0.75000000
Cl         NPT=  781  R0=.000100000 RMT=   2.00000   Z:  17.00000
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=0.07160000 Z=0.25000000
          MULT= 2          ISPLIT=15
      -8: X=0.00000000 Y=0.92840000 Z=0.75000000
Cl         NPT=  781  R0=.000100000 RMT=   2.00000   Z:  17.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -9: X=0.00000000 Y=0.35150000 Z=0.05210000
          MULT= 4          ISPLIT=15
      -9: X=0.00000000 Y=0.64850000 Z=0.94790000
      -9: X=0.00000000 Y=0.35150000 Z=0.44790000
      -9: X=0.00000000 Y=0.64850000 Z=0.55210000
Cl         NPT=  781  R0=.000100000 RMT=   2.00000   Z:  17.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM -10: X=0.00000000 Y=0.52640000 Z=0.25000000
          MULT= 2          ISPLIT=15
     -10: X=0.00000000 Y=0.47360000 Z=0.75000000
Cl         NPT=  781  R0=.000100000 RMT=   2.00000   Z:  17.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000