CXY LATTICE,NONEQUIV.ATOMS   5   63 Cmcm    
MODE OF CALC=RELA unit=bohr
  8.531169 22.496056 29.929294 90.000000 90.000000 90.000000
ATOM  -1: X=0.00000000 Y=0.04217000 Z=0.25000000
          MULT= 2          ISPLIT=15
      -1: X=0.00000000 Y=0.95783000 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  -2: X=0.00000000 Y=0.32862000 Z=0.09778000
          MULT= 4          ISPLIT=15
      -2: X=0.00000000 Y=0.67138000 Z=0.90222000
      -2: X=0.00000000 Y=0.32862000 Z=0.40222000
      -2: X=0.00000000 Y=0.67138000 Z=0.59778000
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=0.77147000 Z=0.25000000
          MULT= 2          ISPLIT=15
      -3: X=0.00000000 Y=0.22853000 Z=0.75000000
Sn         NPT=  781  R0=.000010000 RMT=   2.00000   Z:  50.00000
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=0.61708000 Z=0.10719000
          MULT= 4          ISPLIT=15
      -4: X=0.00000000 Y=0.38292000 Z=0.89281000
      -4: X=0.00000000 Y=0.61708000 Z=0.39281000
      -4: X=0.00000000 Y=0.38292000 Z=0.60719000
Sn         NPT=  781  R0=.000010000 RMT=   2.00000   Z:  50.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 2          ISPLIT=15
      -5: X=0.00000000 Y=0.00000000 Z=0.50000000
Sn         NPT=  781  R0=.000010000 RMT=   2.00000   Z:  50.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000