B   LATTICE,NONEQUIV.ATOMS   7   73 Ibca                                       
MODE OF CALC=RELA unit=bohr                                                    
 13.572013 31.985505 40.808636 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.25000000 Z=0.25280000
          MULT= 4          ISPLIT= 8
      -1: X=0.00000000 Y=0.75000000 Z=0.74720000
      -1: X=0.00000000 Y=0.25000000 Z=0.75280000
      -1: X=0.00000000 Y=0.75000000 Z=0.24720000
Na         NPT=  781  R0=.000100000 RMT= 2.50000     Z:  11.00000              
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=0.41210000
          MULT= 4          ISPLIT= 8
      -2: X=0.00000000 Y=0.75000000 Z=0.58790000
      -2: X=0.00000000 Y=0.25000000 Z=0.91210000
      -2: X=0.00000000 Y=0.75000000 Z=0.08790000
Na         NPT=  781  R0=.000100000 RMT= 2.50000     Z:  11.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.22270000 Y=0.07650000 Z=0.33520000
          MULT= 8          ISPLIT= 8
      -3: X=0.77730000 Y=0.92350000 Z=0.66480000
      -3: X=0.22270000 Y=0.57650000 Z=0.66480000
      -3: X=0.77730000 Y=0.42350000 Z=0.33520000
      -3: X=0.77730000 Y=0.07650000 Z=0.83520000
      -3: X=0.22270000 Y=0.92350000 Z=0.16480000
      -3: X=0.77730000 Y=0.57650000 Z=0.16480000
      -3: X=0.22270000 Y=0.42350000 Z=0.83520000
K          NPT=  781  R0=.000050000 RMT= 2.50000     Z:  19.00000              
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=0.07540000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -4: X=0.75000000 Y=0.92460000 Z=0.00000000
      -4: X=0.25000000 Y=0.57540000 Z=0.00000000
      -4: X=0.75000000 Y=0.42460000 Z=0.00000000
K          NPT=  781  R0=.000050000 RMT= 2.50000     Z:  19.00000              
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=0.25000000 Z=0.08240000
          MULT= 4          ISPLIT= 8
      -5: X=0.00000000 Y=0.75000000 Z=0.91760000
      -5: X=0.00000000 Y=0.25000000 Z=0.58240000
      -5: X=0.00000000 Y=0.75000000 Z=0.41760000
Sn         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  50.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.21440000 Y=0.13790000 Z=0.16010000
          MULT= 8          ISPLIT= 8
      -6: X=0.78560000 Y=0.86210000 Z=0.83990000
      -6: X=0.21440000 Y=0.63790000 Z=0.83990000
      -6: X=0.78560000 Y=0.36210000 Z=0.16010000
      -6: X=0.78560000 Y=0.13790000 Z=0.66010000
      -6: X=0.21440000 Y=0.86210000 Z=0.33990000
      -6: X=0.78560000 Y=0.63790000 Z=0.33990000
      -6: X=0.21440000 Y=0.36210000 Z=0.66010000
Bi         NPT=  781  R0=.000005000 RMT= 2.50000     Z:  83.00000              
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=0.35290000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -7: X=0.75000000 Y=0.64710000 Z=0.00000000
      -7: X=0.25000000 Y=0.85290000 Z=0.00000000
      -7: X=0.75000000 Y=0.14710000 Z=0.00000000
Bi         NPT=  781  R0=.000005000 RMT= 2.50000     Z:  83.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000