CXZ LATTICE,NONEQUIV.ATOMS   4   15 B2/b                                       
MODE OF CALC=RELA unit=bohr                                                    
 30.857338 12.526995  8.537783 90.000000 90.000000 82.690000                   
ATOM  -1: X=0.00000000 Y=0.25000000 Z=0.37950000
          MULT= 2          ISPLIT= 8
      -1: X=0.00000000 Y=0.75000000 Z=0.62050000
S          NPT=  781  R0=.000100000 RMT= 1.34        Z:  16.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.84620000 Y=0.13160000 Z=0.22470000
          MULT= 4          ISPLIT= 8
      -2: X=0.15380000 Y=0.86840000 Z=0.77530000
      -2: X=0.15380000 Y=0.36840000 Z=0.22470000
      -2: X=0.84620000 Y=0.63160000 Z=0.77530000
S          NPT=  781  R0=.000100000 RMT= 1.34        Z:  16.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.93040000 Y=0.19260000 Z=0.13700000
          MULT= 4          ISPLIT= 8
      -3: X=0.06960000 Y=0.80740000 Z=0.86300000
      -3: X=0.06960000 Y=0.30740000 Z=0.13700000
      -3: X=0.93040000 Y=0.69260000 Z=0.86300000
N          NPT=  781  R0=.000100000 RMT= 1.44        Z:   7.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.67270000 Y=0.37660000 Z=0.04120000
          MULT= 4          ISPLIT= 8
      -4: X=0.32730000 Y=0.62340000 Z=0.95880000
      -4: X=0.32730000 Y=0.12340000 Z=0.04120000
      -4: X=0.67270000 Y=0.87660000 Z=0.95880000
O          NPT=  781  R0=.000100000 RMT= 1.41        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000