CXY LATTICE,NONEQUIV.ATOMS   7   36 Cmc21                                      
MODE OF CALC=RELA unit=bohr                                                    
 16.698376 20.956874 10.192616 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.19308000 Y=0.10546000 Z=0.46673000
          MULT= 4          ISPLIT= 8
      -1: X=0.80692000 Y=0.89454000 Z=0.96673000
      -1: X=0.80692000 Y=0.10546000 Z=0.46673000
      -1: X=0.19308000 Y=0.89454000 Z=0.96673000
Y          NPT=  781  R0=.000010000 RMT= 2.12        Z:  39.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.00000000 Y=0.39768000 Z=0.42176000
          MULT= 2          ISPLIT= 8
      -2: X=0.00000000 Y=0.60232000 Z=0.92176000
Y          NPT=  781  R0=.000010000 RMT= 2.12        Z:  39.00000              
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=0.19366000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -3: X=0.00000000 Y=0.80634000 Z=0.50000000
Ga         NPT=  781  R0=.000050000 RMT= 1.70        Z:  31.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -4: X=0.15600000 Y=0.26100000 Z=0.18200000
          MULT= 4          ISPLIT= 8
      -4: X=0.84400000 Y=0.73900000 Z=0.68200000
      -4: X=0.84400000 Y=0.26100000 Z=0.18200000
      -4: X=0.15600000 Y=0.73900000 Z=0.68200000
O          NPT=  781  R0=.000100000 RMT= 1.54        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=0.33800000 Y=0.01800000 Z=0.20300000
          MULT= 4          ISPLIT= 8
      -5: X=0.66200000 Y=0.98200000 Z=0.70300000
      -5: X=0.66200000 Y=0.01800000 Z=0.20300000
      -5: X=0.33800000 Y=0.98200000 Z=0.70300000
O          NPT=  781  R0=.000100000 RMT= 1.54        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  -6: X=0.00000000 Y=0.05200000 Z=0.13100000
          MULT= 2          ISPLIT= 8
      -6: X=0.00000000 Y=0.94800000 Z=0.63100000
O          NPT=  781  R0=.000100000 RMT= 1.54        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -7: X=0.00000000 Y=0.21200000 Z=0.65300000
          MULT= 2          ISPLIT= 8
      -7: X=0.00000000 Y=0.78800000 Z=0.15300000
O          NPT=  781  R0=.000100000 RMT= 1.54        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000