CXY LATTICE,NONEQUIV.ATOMS   3   36 Cmc21                                      
MODE OF CALC=RELA unit=bohr                                                    
 16.421720 10.166727  9.184069 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.12900000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -1: X=0.00000000 Y=0.87100000 Z=0.50000000
P          NPT=  781  R0=.000100000 RMT= 1.27        Z:  15.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -2: X=0.00000000 Y=0.08500000 Z=0.70300000
          MULT= 2          ISPLIT= 8
      -2: X=0.00000000 Y=0.91500000 Z=0.20300000
N          NPT=  781  R0=.000100000 RMT= 1.41        Z:   7.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -3: X=0.12500000 Y=0.29900000 Z=0.06800000
          MULT= 4          ISPLIT= 8
      -3: X=0.87500000 Y=0.70100000 Z=0.56800000
      -3: X=0.87500000 Y=0.29900000 Z=0.06800000
      -3: X=0.12500000 Y=0.70100000 Z=0.56800000
F          NPT=  781  R0=.000100000 RMT= 1.47        Z:   9.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000