CXY LATTICE,NONEQUIV.ATOMS   4   63 Cmcm                                       
MODE OF CALC=RELA unit=bohr                                                    
 13.093345 13.744923 13.890054 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.03831000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -1: X=0.00000000 Y=0.96169000 Z=0.75000000
I          NPT=  781  R0=.000010000 RMT= 1.78        Z:  53.00000              
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=0.50000000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -2: X=0.00000000 Y=0.50000000 Z=0.50000000
Na         NPT=  781  R0=.000100000 RMT= 2.16        Z:  11.00000              
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=0.18810000 Z=0.06120000
          MULT= 4          ISPLIT= 8
      -3: X=0.00000000 Y=0.81190000 Z=0.93880000
      -3: X=0.00000000 Y=0.18810000 Z=0.43880000
      -3: X=0.00000000 Y=0.81190000 Z=0.56120000
O          NPT=  781  R0=.000100000 RMT= 1.53        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  -4: X=0.28920000 Y=0.03720000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -4: X=0.71080000 Y=0.96280000 Z=0.75000000
      -4: X=0.71080000 Y=0.03720000 Z=0.25000000
      -4: X=0.28920000 Y=0.96280000 Z=0.75000000
F          NPT=  781  R0=.000100000 RMT= 1.79        Z:   9.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000