CXY LATTICE,NONEQUIV.ATOMS   5   64 Cmca                                       
MODE OF CALC=RELA unit=bohr                                                    
 13.781773 30.313097 13.619256 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.25000000 Y=0.10217000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -1: X=0.75000000 Y=0.89783000 Z=0.75000000
      -1: X=0.25000000 Y=0.60217000 Z=0.25000000
      -1: X=0.75000000 Y=0.39783000 Z=0.75000000
Cd         NPT=  781  R0=.000010000 RMT= 2.33        Z:  48.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -2: X=0.00000000 Y=0.20819000 Z=0.16571000
          MULT= 4          ISPLIT= 8
      -2: X=0.00000000 Y=0.79181000 Z=0.83429000
      -2: X=0.00000000 Y=0.70819000 Z=0.33429000
      -2: X=0.00000000 Y=0.29181000 Z=0.66571000
Cl         NPT=  781  R0=.000100000 RMT= 2.23        Z:  17.00000              
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=0.40278000 Z=0.22449000
          MULT= 4          ISPLIT= 8
      -3: X=0.00000000 Y=0.59722000 Z=0.77551000
      -3: X=0.00000000 Y=0.90278000 Z=0.27551000
      -3: X=0.00000000 Y=0.09722000 Z=0.72449000
I          NPT=  781  R0=.000010000 RMT= 1.83        Z:  53.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -4: X=0.19190000 Y=0.40273000 Z=0.06470000
          MULT= 8          ISPLIT= 8
      -4: X=0.80810000 Y=0.59727000 Z=0.93530000
      -4: X=0.19190000 Y=0.90273000 Z=0.43530000
      -4: X=0.80810000 Y=0.09727000 Z=0.56470000
      -4: X=0.80810000 Y=0.40273000 Z=0.06470000
      -4: X=0.19190000 Y=0.59727000 Z=0.93530000
      -4: X=0.80810000 Y=0.90273000 Z=0.43530000
      -4: X=0.19190000 Y=0.09727000 Z=0.56470000
O          NPT=  781  R0=.000100000 RMT= 1.57        Z:   8.00000              
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=0.01433000 Z=0.22030000
          MULT= 4          ISPLIT= 8
      -5: X=0.00000000 Y=0.98567000 Z=0.77970000
      -5: X=0.00000000 Y=0.51433000 Z=0.27970000
      -5: X=0.00000000 Y=0.48567000 Z=0.72030000
O          NPT=  781  R0=.000100000 RMT= 1.57        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000