CXY LATTICE,NONEQUIV.ATOMS   6   63 Cmcm                                       
MODE OF CALC=RELA unit=bohr                                                    
 21.875092 13.318034 21.987342 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.21456000 Y=0.00000000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -1: X=0.78544000 Y=0.00000000 Z=0.00000000
      -1: X=0.21456000 Y=0.00000000 Z=0.50000000
      -1: X=0.78544000 Y=0.00000000 Z=0.50000000
K          NPT=  781  R0=.000050000 RMT= 2.50000     Z:  19.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -2: X=0.14314000 Y=0.38609000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -2: X=0.85686000 Y=0.61391000 Z=0.75000000
      -2: X=0.85686000 Y=0.38609000 Z=0.25000000
      -2: X=0.14314000 Y=0.61391000 Z=0.75000000
Zn         NPT=  781  R0=.000050000 RMT= 2.36        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  -3: X=0.00000000 Y=0.65236000 Z=0.10852000
          MULT= 4          ISPLIT= 8
      -3: X=0.00000000 Y=0.34764000 Z=0.89148000
      -3: X=0.00000000 Y=0.65236000 Z=0.39148000
      -3: X=0.00000000 Y=0.34764000 Z=0.60852000
Zn         NPT=  781  R0=.000050000 RMT= 2.36        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  -4: X=0.00000000 Y=0.00784000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -4: X=0.00000000 Y=0.99216000 Z=0.75000000
Zn         NPT=  781  R0=.000050000 RMT= 2.36        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=0.34153000 Y=0.25779000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -5: X=0.65847000 Y=0.74221000 Z=0.75000000
      -5: X=0.65847000 Y=0.25779000 Z=0.25000000
      -5: X=0.34153000 Y=0.74221000 Z=0.75000000
As         NPT=  781  R0=.000050000 RMT= 2.25        Z:  33.00000              
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=0.27484000 Z=0.09769000
          MULT= 4          ISPLIT= 8
      -6: X=0.00000000 Y=0.72516000 Z=0.90231000
      -6: X=0.00000000 Y=0.27484000 Z=0.40231000
      -6: X=0.00000000 Y=0.72516000 Z=0.59769000
As         NPT=  781  R0=.000050000 RMT= 2.25        Z:  33.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000