CXY LATTICE,NONEQUIV.ATOMS   6   68 Ccca                                       
MODE OF CALC=RELA unit=bohr                                                    
 15.522210 52.523993 15.521455 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.25000000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -1: X=0.00000000 Y=0.75000000 Z=0.75000000
Sn         NPT=  781  R0=.000010000 RMT= 2.38        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  -2: X=0.16248000 Y=0.31028000 Z=0.08755000
          MULT= 8          ISPLIT= 8
      -2: X=0.83752000 Y=0.68972000 Z=0.91245000
      -2: X=0.16248000 Y=0.81028000 Z=0.91245000
      -2: X=0.83752000 Y=0.18972000 Z=0.08755000
      -2: X=0.83752000 Y=0.81028000 Z=0.58755000
      -2: X=0.16248000 Y=0.18972000 Z=0.41245000
      -2: X=0.83752000 Y=0.31028000 Z=0.41245000
      -2: X=0.16248000 Y=0.68972000 Z=0.58755000
Se         NPT=  781  R0=.000050000 RMT= 2.27        Z:  34.00000              
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=0.12400000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -3: X=0.00000000 Y=0.87600000 Z=0.75000000
      -3: X=0.00000000 Y=0.62400000 Z=0.75000000
      -3: X=0.00000000 Y=0.37600000 Z=0.25000000
Sn         NPT=  781  R0=.000010000 RMT= 2.38        Z:  50.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -4: X=0.18133000 Y=0.07729000 Z=0.06853000
          MULT= 8          ISPLIT= 8
      -4: X=0.81867000 Y=0.92271000 Z=0.93147000
      -4: X=0.18133000 Y=0.57729000 Z=0.93147000
      -4: X=0.81867000 Y=0.42271000 Z=0.06853000
      -4: X=0.81867000 Y=0.57729000 Z=0.56853000
      -4: X=0.18133000 Y=0.42271000 Z=0.43147000
      -4: X=0.81867000 Y=0.07729000 Z=0.43147000
      -4: X=0.18133000 Y=0.92271000 Z=0.56853000
Se         NPT=  781  R0=.000050000 RMT= 2.27        Z:  34.00000              
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=0.64569000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -5: X=0.00000000 Y=0.35431000 Z=0.75000000
      -5: X=0.00000000 Y=0.14569000 Z=0.75000000
      -5: X=0.00000000 Y=0.85431000 Z=0.25000000
K          NPT=  781  R0=.000050000 RMT= 2.50000     Z:  19.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -6: X=0.00000000 Y=0.51663000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -6: X=0.00000000 Y=0.48337000 Z=0.75000000
      -6: X=0.00000000 Y=0.01663000 Z=0.75000000
      -6: X=0.00000000 Y=0.98337000 Z=0.25000000
K          NPT=  781  R0=.000050000 RMT= 2.50000     Z:  19.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000