CXY LATTICE,NONEQUIV.ATOMS   7   63 Cmcm                                       
MODE OF CALC=RELA unit=bohr                                                    
 25.086303 10.926397 21.535508 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -1: X=0.00000000 Y=0.00000000 Z=0.50000000
Au         NPT=  781  R0=.000005000 RMT= 2.06        Z:  79.00000              
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=0.59670000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -2: X=0.00000000 Y=0.40330000 Z=0.75000000
Ag         NPT=  781  R0=.000010000 RMT= 2.17        Z:  47.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.35330000 Y=0.00000000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -3: X=0.64670000 Y=0.00000000 Z=0.00000000
      -3: X=0.35330000 Y=0.00000000 Z=0.50000000
      -3: X=0.64670000 Y=0.00000000 Z=0.50000000
Ba         NPT=  781  R0=.000010000 RMT= 2.41        Z:  56.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -4: X=0.14550000 Y=0.06880000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -4: X=0.85450000 Y=0.93120000 Z=0.75000000
      -4: X=0.85450000 Y=0.06880000 Z=0.25000000
      -4: X=0.14550000 Y=0.93120000 Z=0.75000000
Ba         NPT=  781  R0=.000010000 RMT= 2.41        Z:  56.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.15500000 Y=0.00000000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -5: X=0.84500000 Y=0.00000000 Z=0.00000000
      -5: X=0.15500000 Y=0.00000000 Z=0.50000000
      -5: X=0.84500000 Y=0.00000000 Z=0.50000000
O          NPT=  781  R0=.000100000 RMT= 1.68        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  -6: X=0.00000000 Y=0.26900000 Z=0.10900000
          MULT= 4          ISPLIT= 8
      -6: X=0.00000000 Y=0.73100000 Z=0.89100000
      -6: X=0.00000000 Y=0.26900000 Z=0.39100000
      -6: X=0.00000000 Y=0.73100000 Z=0.60900000
O          NPT=  781  R0=.000100000 RMT= 1.68        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=0.33800000 Y=0.10200000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -7: X=0.66200000 Y=0.89800000 Z=0.75000000
      -7: X=0.66200000 Y=0.10200000 Z=0.25000000
      -7: X=0.33800000 Y=0.89800000 Z=0.75000000
O          NPT=  781  R0=.000100000 RMT= 1.68        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000