B   LATTICE,NONEQUIV.ATOMS   7   74 Imma    
MODE OF CALC=RELA unit=bohr
 10.395383 41.573975 10.372707 90.000000 90.000000 90.000000
ATOM  -1: X=0.00000000 Y=0.14700000 Z=0.49900000
          MULT= 4          ISPLIT=15
      -1: X=0.00000000 Y=0.85300000 Z=0.50100000
      -1: X=0.00000000 Y=0.64700000 Z=0.50100000
      -1: X=0.00000000 Y=0.35300000 Z=0.49900000
Nb         NPT=  781  R0=.000010000 RMT=   2.00000   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  -2: X=0.00000000 Y=0.25000000 Z=0.00800000
          MULT= 2          ISPLIT=15
      -2: X=0.00000000 Y=0.75000000 Z=0.99200000
La         NPT=  781  R0=.000010000 RMT=   2.00000   Z:  57.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 2          ISPLIT=15
      -3: X=0.00000000 Y=0.50000000 Z=0.00000000
Rb         NPT=  781  R0=.000010000 RMT=   2.00000   Z:  37.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.00000000 Y=0.25000000 Z=0.44700000
          MULT= 2          ISPLIT=15
      -4: X=0.00000000 Y=0.75000000 Z=0.55300000
O          NPT=  781  R0=.000100000 RMT=   2.00000   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=0.06700000 Z=0.54700000
          MULT= 4          ISPLIT=15
      -5: X=0.00000000 Y=0.93300000 Z=0.45300000
      -5: X=0.00000000 Y=0.56700000 Z=0.45300000
      -5: X=0.00000000 Y=0.43300000 Z=0.54700000
O          NPT=  781  R0=.000100000 RMT=   2.00000   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  -6: X=0.25000000 Y=0.15600000 Z=0.25000000
          MULT= 4          ISPLIT=15
      -6: X=0.75000000 Y=0.84400000 Z=0.75000000
      -6: X=0.25000000 Y=0.65600000 Z=0.75000000
      -6: X=0.75000000 Y=0.34400000 Z=0.25000000
O          NPT=  781  R0=.000100000 RMT=   2.00000   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  -7: X=0.25000000 Y=0.67200000 Z=0.25000000
          MULT= 4          ISPLIT=15
      -7: X=0.75000000 Y=0.32800000 Z=0.75000000
      -7: X=0.25000000 Y=0.17200000 Z=0.75000000
      -7: X=0.75000000 Y=0.82800000 Z=0.25000000
O          NPT=  781  R0=.000100000 RMT=   2.00000   Z:   8.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000