CXY LATTICE,NONEQUIV.ATOMS   6   64 Cmca                                       
MODE OF CALC=RELA unit=bohr                                                    
 37.348547 12.819902 28.102117 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.14870000 Z=0.36280000
          MULT= 4          ISPLIT= 8
      -1: X=0.00000000 Y=0.85130000 Z=0.63720000
      -1: X=0.00000000 Y=0.64870000 Z=0.13720000
      -1: X=0.00000000 Y=0.35130000 Z=0.86280000
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=0.15770000 Y=0.27340000 Z=0.17650000
          MULT= 8          ISPLIT= 8
      -2: X=0.84230000 Y=0.72660000 Z=0.82350000
      -2: X=0.15770000 Y=0.77340000 Z=0.32350000
      -2: X=0.84230000 Y=0.22660000 Z=0.67650000
      -2: X=0.84230000 Y=0.27340000 Z=0.17650000
      -2: X=0.15770000 Y=0.72660000 Z=0.82350000
      -2: X=0.84230000 Y=0.77340000 Z=0.32350000
      -2: X=0.15770000 Y=0.22660000 Z=0.67650000
K          NPT=  781  R0=.000050000 RMT= 2.50000     Z:  19.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.08350000 Y=0.00000000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -3: X=0.91650000 Y=0.00000000 Z=0.00000000
      -3: X=0.08350000 Y=0.50000000 Z=0.50000000
      -3: X=0.91650000 Y=0.50000000 Z=0.50000000
In         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  49.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -4: X=0.26090000 Y=0.00000000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -4: X=0.73910000 Y=0.00000000 Z=0.00000000
      -4: X=0.26090000 Y=0.50000000 Z=0.50000000
      -4: X=0.73910000 Y=0.50000000 Z=0.50000000
In         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  49.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -5: X=0.00000000 Y=0.16210000 Z=0.11790000
          MULT= 4          ISPLIT= 8
      -5: X=0.00000000 Y=0.83790000 Z=0.88210000
      -5: X=0.00000000 Y=0.66210000 Z=0.38210000
      -5: X=0.00000000 Y=0.33790000 Z=0.61790000
As         NPT=  781  R0=.000050000 RMT= 2.42        Z:  33.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -6: X=0.32540000 Y=0.27470000 Z=0.09720000
          MULT= 8          ISPLIT= 8
      -6: X=0.67460000 Y=0.72530000 Z=0.90280000
      -6: X=0.32540000 Y=0.77470000 Z=0.40280000
      -6: X=0.67460000 Y=0.22530000 Z=0.59720000
      -6: X=0.67460000 Y=0.27470000 Z=0.09720000
      -6: X=0.32540000 Y=0.72530000 Z=0.90280000
      -6: X=0.67460000 Y=0.77470000 Z=0.40280000
      -6: X=0.32540000 Y=0.22530000 Z=0.59720000
As         NPT=  781  R0=.000050000 RMT= 2.42        Z:  33.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000