CXY LATTICE,NONEQUIV.ATOMS   6   63 Cmcm                                       
MODE OF CALC=RELA unit=bohr                                                    
 17.806889 17.806889 18.351130 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.20400000 Y=0.23700000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -1: X=0.79600000 Y=0.76300000 Z=0.75000000
      -1: X=0.79600000 Y=0.23700000 Z=0.25000000
      -1: X=0.20400000 Y=0.76300000 Z=0.75000000
Ag         NPT=  781  R0=.000010000 RMT= 2.45        Z:  47.00000              
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=0.26300000 Z=0.02500000
          MULT= 4          ISPLIT= 8
      -2: X=0.00000000 Y=0.73700000 Z=0.97500000
      -2: X=0.00000000 Y=0.26300000 Z=0.47500000
      -2: X=0.00000000 Y=0.73700000 Z=0.52500000
Ag         NPT=  781  R0=.000010000 RMT= 2.45        Z:  47.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -3: X=0.29400000 Y=0.00000000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -3: X=0.70600000 Y=0.00000000 Z=0.00000000
      -3: X=0.29400000 Y=0.00000000 Z=0.50000000
      -3: X=0.70600000 Y=0.00000000 Z=0.50000000
Ag         NPT=  781  R0=.000010000 RMT= 2.45        Z:  47.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -4: X=0.25000000 Y=0.25000000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -4: X=0.25000000 Y=0.25000000 Z=0.50000000
      -4: X=0.75000000 Y=0.25000000 Z=0.00000000
      -4: X=0.75000000 Y=0.25000000 Z=0.50000000
S          NPT=  781  R0=.000100000 RMT= 2.00        Z:  16.00000              
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=0.04600000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -5: X=0.00000000 Y=0.95400000 Z=0.75000000
Br         NPT=  781  R0=.000050000 RMT= 2.41        Z:  35.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -6: X=0.00000000 Y=0.50700000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -6: X=0.00000000 Y=0.49300000 Z=0.75000000
Br         NPT=  781  R0=.000050000 RMT= 2.41        Z:  35.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000