CXY LATTICE,NONEQUIV.ATOMS  10   63 Cmcm                                       
MODE OF CALC=RELA unit=bohr                                                    
  8.468619 37.522402 31.679369 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.01592000 Z=0.12225000
          MULT= 4          ISPLIT= 8
      -1: X=0.00000000 Y=0.98408000 Z=0.87775000
      -1: X=0.00000000 Y=0.01592000 Z=0.37775000
      -1: X=0.00000000 Y=0.98408000 Z=0.62225000
Ba         NPT=  781  R0=.000010000 RMT= 2.50000     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  -2: X=0.00000000 Y=0.17141000 Z=0.56801000
          MULT= 4          ISPLIT= 8
      -2: X=0.00000000 Y=0.82859000 Z=0.43199000
      -2: X=0.00000000 Y=0.17141000 Z=0.93199000
      -2: X=0.00000000 Y=0.82859000 Z=0.06801000
Ba         NPT=  781  R0=.000010000 RMT= 2.50000     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  -3: X=0.00000000 Y=0.65051000 Z=0.12531000
          MULT= 4          ISPLIT= 8
      -3: X=0.00000000 Y=0.34949000 Z=0.87469000
      -3: X=0.00000000 Y=0.65051000 Z=0.37469000
      -3: X=0.00000000 Y=0.34949000 Z=0.62531000
Cd         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  48.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -4: X=0.00000000 Y=0.29544000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -4: X=0.00000000 Y=0.70456000 Z=0.75000000
Cd         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  48.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -5: X=0.00000000 Y=0.21937000 Z=0.11817000
          MULT= 4          ISPLIT= 8
      -5: X=0.00000000 Y=0.78063000 Z=0.88183000
      -5: X=0.00000000 Y=0.21937000 Z=0.38183000
      -5: X=0.00000000 Y=0.78063000 Z=0.61817000
P          NPT=  781  R0=.000100000 RMT= 2.13        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  -6: X=0.00000000 Y=0.44360000 Z=0.01143000
          MULT= 4          ISPLIT= 8
      -6: X=0.00000000 Y=0.55640000 Z=0.98857000
      -6: X=0.00000000 Y=0.44360000 Z=0.48857000
      -6: X=0.00000000 Y=0.55640000 Z=0.51143000
P          NPT=  781  R0=.000100000 RMT= 2.13        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  -7: X=0.00000000 Y=0.56964000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -7: X=0.00000000 Y=0.43036000 Z=0.75000000
P          NPT=  781  R0=.000100000 RMT= 2.13        Z:  15.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -8: X=0.00000000 Y=0.87910000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -8: X=0.00000000 Y=0.12090000 Z=0.75000000
P          NPT=  781  R0=.000100000 RMT= 2.13        Z:  15.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -9: X=0.00000000 Y=0.15150000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -9: X=0.00000000 Y=0.84850000 Z=0.75000000
Li         NPT=  781  R0=.000100000 RMT= 2.19        Z:   3.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM -10: X=0.00000000 Y=0.43750000 Z=0.25000000
          MULT= 2          ISPLIT= 8
     -10: X=0.00000000 Y=0.56250000 Z=0.75000000
Li         NPT=  781  R0=.000100000 RMT= 2.19        Z:   3.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000