B   LATTICE,NONEQUIV.ATOMS   9   46 Ima2                                       
MODE OF CALC=RELA unit=bohr                                                    
 13.850748 19.589846 13.850748 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.00000000 Z=0.50780000
          MULT= 2          ISPLIT= 8
      -1: X=0.00000000 Y=0.50000000 Z=0.00780000
Cd         NPT=  781  R0=.000010000 RMT= 2.26        Z:  48.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.25000000 Y=0.25350000 Z=0.25250000
          MULT= 2          ISPLIT= 8
      -2: X=0.75000000 Y=0.74650000 Z=0.25250000
Cd         NPT=  781  R0=.000010000 RMT= 2.26        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  -3: X=0.00000000 Y=0.00000000 Z=0.00760000
          MULT= 2          ISPLIT= 8
      -3: X=0.00000000 Y=0.50000000 Z=0.50760000
Nb         NPT=  781  R0=.000010000 RMT= 1.87        Z:  41.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.25000000 Y=0.74530000 Z=0.26330000
          MULT= 2          ISPLIT= 8
      -4: X=0.75000000 Y=0.25470000 Z=0.26330000
Nb         NPT=  781  R0=.000010000 RMT= 1.87        Z:  41.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -5: X=0.25000000 Y=0.12540000 Z=0.49850000
          MULT= 2          ISPLIT= 8
      -5: X=0.75000000 Y=0.87460000 Z=0.49850000
O          NPT=  781  R0=.000100000 RMT= 1.69        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=0.25000000 Y=0.82070000 Z=0.49920000
          MULT= 2          ISPLIT= 8
      -6: X=0.75000000 Y=0.17930000 Z=0.49920000
O          NPT=  781  R0=.000100000 RMT= 1.69        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=0.25000000 Y=0.43120000 Z=0.49280000
          MULT= 2          ISPLIT= 8
      -7: X=0.75000000 Y=0.56880000 Z=0.49280000
O          NPT=  781  R0=.000100000 RMT= 1.69        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  -8: X=0.05330000 Y=0.62410000 Z=0.30020000
          MULT= 4          ISPLIT= 8
      -8: X=0.94670000 Y=0.37590000 Z=0.30020000
      -8: X=0.94670000 Y=0.12410000 Z=0.80020000
      -8: X=0.05330000 Y=0.87590000 Z=0.80020000
O          NPT=  781  R0=.000100000 RMT= 1.69        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  -9: X=0.55810000 Y=0.12640000 Z=0.18900000
          MULT= 4          ISPLIT= 8
      -9: X=0.44190000 Y=0.87360000 Z=0.18900000
      -9: X=0.44190000 Y=0.62640000 Z=0.68900000
      -9: X=0.55810000 Y=0.37360000 Z=0.68900000
O          NPT=  781  R0=.000100000 RMT= 1.69        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000