CXY LATTICE,NONEQUIV.ATOMS   5   63 Cmcm                                       
MODE OF CALC=RELA unit=bohr                                                    
 10.639914 17.089549 13.299326 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.68300000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -1: X=0.00000000 Y=0.31700000 Z=0.75000000
Na         NPT=  781  R0=.000100000 RMT= 2.17        Z:  11.00000              
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=0.00000000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -2: X=0.00000000 Y=0.00000000 Z=0.50000000
Na         NPT=  781  R0=.000100000 RMT= 2.17        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=0.34830000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -3: X=0.00000000 Y=0.65170000 Z=0.75000000
S          NPT=  781  R0=.000100000 RMT= 1.35        Z:  16.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -4: X=0.21770000 Y=0.43850000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -4: X=0.78230000 Y=0.56150000 Z=0.75000000
      -4: X=0.78230000 Y=0.43850000 Z=0.25000000
      -4: X=0.21770000 Y=0.56150000 Z=0.75000000
O          NPT=  781  R0=.000100000 RMT= 1.42        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=0.25680000 Z=0.06840000
          MULT= 4          ISPLIT= 8
      -5: X=0.00000000 Y=0.74320000 Z=0.93160000
      -5: X=0.00000000 Y=0.25680000 Z=0.43160000
      -5: X=0.00000000 Y=0.74320000 Z=0.56840000
O          NPT=  781  R0=.000100000 RMT= 1.42        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000