CXY LATTICE,NONEQUIV.ATOMS   6   63 Cmcm    
MODE OF CALC=RELA unit=bohr
  8.599766 31.658582 17.261136 90.000000 90.000000 90.000000
ATOM  -1: X=0.00000000 Y=0.79365000 Z=0.25000000
          MULT= 2          ISPLIT=15
      -1: X=0.00000000 Y=0.20635000 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=0.00000000 Z=0.00000000
          MULT= 2          ISPLIT=15
      -2: 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  -3: X=0.00000000 Y=0.44323000 Z=0.25000000
          MULT= 2          ISPLIT=15
      -3: X=0.00000000 Y=0.55677000 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=0.18519000 Z=0.10868000
          MULT= 4          ISPLIT=15
      -4: X=0.00000000 Y=0.81481000 Z=0.89132000
      -4: X=0.00000000 Y=0.18519000 Z=0.39132000
      -4: X=0.00000000 Y=0.81481000 Z=0.60868000
Zn         NPT=  781  R0=.000050000 RMT=   2.00000   Z:  30.00000
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=0.34410000 Z=0.01518000
          MULT= 4          ISPLIT=15
      -5: X=0.00000000 Y=0.65590000 Z=0.98482000
      -5: X=0.00000000 Y=0.34410000 Z=0.48482000
      -5: X=0.00000000 Y=0.65590000 Z=0.51518000
Zn         NPT=  781  R0=.000050000 RMT=   2.00000   Z:  30.00000
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=0.60207000 Z=0.25000000
          MULT= 2          ISPLIT=15
      -6: X=0.00000000 Y=0.39793000 Z=0.75000000
Zn         NPT=  781  R0=.000050000 RMT=   2.00000   Z:  30.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000