CXY LATTICE,NONEQUIV.ATOMS   7   63 Cmcm                                       
MODE OF CALC=RELA unit=bohr                                                    
 11.980864 50.609700 11.967636 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.22846000 Y=0.30297000 Z=0.02162000
          MULT= 8          ISPLIT= 8
      -1: X=0.77154000 Y=0.69703000 Z=0.97838000
      -1: X=0.22846000 Y=0.30297000 Z=0.47838000
      -1: X=0.77154000 Y=0.69703000 Z=0.52162000
      -1: X=0.77154000 Y=0.30297000 Z=0.02162000
      -1: X=0.22846000 Y=0.69703000 Z=0.97838000
      -1: X=0.77154000 Y=0.30297000 Z=0.47838000
      -1: X=0.22846000 Y=0.69703000 Z=0.52162000
Sn         NPT=  781  R0=.000010000 RMT= 2.45        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=0.27951000 Y=0.00000000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -2: X=0.72049000 Y=0.00000000 Z=0.00000000
      -2: X=0.27951000 Y=0.00000000 Z=0.50000000
      -2: X=0.72049000 Y=0.00000000 Z=0.50000000
Zn         NPT=  781  R0=.000050000 RMT= 2.45        Z:  30.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -3: X=0.00000000 Y=0.05220000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -3: X=0.00000000 Y=0.94780000 Z=0.75000000
Sn         NPT=  781  R0=.000010000 RMT= 2.45        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=0.00000000 Y=0.14959000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -4: X=0.00000000 Y=0.85041000 Z=0.75000000
Zn         NPT=  781  R0=.000050000 RMT= 2.45        Z:  30.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -5: X=0.00000000 Y=0.43008000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -5: X=0.00000000 Y=0.56992000 Z=0.75000000
Sn         NPT=  781  R0=.000010000 RMT= 2.45        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  -6: X=0.00000000 Y=0.59891000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -6: X=0.00000000 Y=0.40109000 Z=0.75000000
Ca         NPT=  781  R0=.000050000 RMT= 2.50000     Z:  20.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -7: X=0.00000000 Y=0.90289000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -7: X=0.00000000 Y=0.09711000 Z=0.75000000
Ca         NPT=  781  R0=.000050000 RMT= 2.50000     Z:  20.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000