CXZ LATTICE,NONEQUIV.ATOMS   9   15 B2/b                                       
MODE OF CALC=RELA unit=bohr                                                    
 18.349241 30.356561 21.151705 90.000000 90.000000 74.900000                   
ATOM  -1: X=0.61860000 Y=0.31980000 Z=0.36620000
          MULT= 4          ISPLIT= 8
      -1: X=0.38140000 Y=0.68020000 Z=0.63380000
      -1: X=0.38140000 Y=0.18020000 Z=0.36620000
      -1: X=0.61860000 Y=0.81980000 Z=0.63380000
Se         NPT=  781  R0=.000050000 RMT= 2.27        Z:  34.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.70220000 Y=0.01790000 Z=0.06630000
          MULT= 4          ISPLIT= 8
      -2: X=0.29780000 Y=0.98210000 Z=0.93370000
      -2: X=0.29780000 Y=0.48210000 Z=0.06630000
      -2: X=0.70220000 Y=0.51790000 Z=0.93370000
Se         NPT=  781  R0=.000050000 RMT= 2.27        Z:  34.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.95660000 Y=0.39690000 Z=0.22850000
          MULT= 4          ISPLIT= 8
      -3: X=0.04340000 Y=0.60310000 Z=0.77150000
      -3: X=0.04340000 Y=0.10310000 Z=0.22850000
      -3: X=0.95660000 Y=0.89690000 Z=0.77150000
Se         NPT=  781  R0=.000050000 RMT= 2.27        Z:  34.00000              
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=0.54780000
          MULT= 2          ISPLIT= 8
      -4: X=0.00000000 Y=0.75000000 Z=0.45220000
Se         NPT=  781  R0=.000050000 RMT= 2.27        Z:  34.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.84070000 Y=0.36360000 Z=0.41370000
          MULT= 4          ISPLIT= 8
      -5: X=0.15930000 Y=0.63640000 Z=0.58630000
      -5: X=0.15930000 Y=0.13640000 Z=0.41370000
      -5: X=0.84070000 Y=0.86360000 Z=0.58630000
Sn         NPT=  781  R0=.000010000 RMT= 2.39        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=0.72470000 Y=0.13930000 Z=0.27200000
          MULT= 4          ISPLIT= 8
      -6: X=0.27530000 Y=0.86070000 Z=0.72800000
      -6: X=0.27530000 Y=0.36070000 Z=0.27200000
      -6: X=0.72470000 Y=0.63930000 Z=0.72800000
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  -7: X=0.60730000 Y=0.42660000 Z=0.14410000
          MULT= 4          ISPLIT= 8
      -7: X=0.39270000 Y=0.57340000 Z=0.85590000
      -7: X=0.39270000 Y=0.07340000 Z=0.14410000
      -7: X=0.60730000 Y=0.92660000 Z=0.85590000
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  -8: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -8: X=0.00000000 Y=0.50000000 Z=0.00000000
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  -9: X=0.00000000 Y=0.25000000 Z=0.07200000
          MULT= 2          ISPLIT= 8
      -9: X=0.00000000 Y=0.75000000 Z=0.92800000
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