CXZ LATTICE,NONEQUIV.ATOMS   7   15 B2/b    
MODE OF CALC=RELA unit=bohr
 30.040976 13.670846  7.977290 90.000000 90.000000 65.870000
ATOM  -1: X=0.00000000 Y=0.25000000 Z=0.16767000
          MULT= 2          ISPLIT=15
      -1: X=0.00000000 Y=0.75000000 Z=0.83233000
U          NPT=  781  R0=.000005000 RMT=   2.00000   Z:  92.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.78370000 Y=0.16790000 Z=0.14540000
          MULT= 4          ISPLIT=15
      -2: X=0.21630000 Y=0.83210000 Z=0.85460000
      -2: X=0.21630000 Y=0.33210000 Z=0.14540000
      -2: X=0.78370000 Y=0.66790000 Z=0.85460000
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  -3: X=0.65480000 Y=0.49290000 Z=0.15100000
          MULT= 4          ISPLIT=15
      -3: X=0.34520000 Y=0.50710000 Z=0.84900000
      -3: X=0.34520000 Y=0.00710000 Z=0.15100000
      -3: X=0.65480000 Y=0.99290000 Z=0.84900000
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  -4: X=0.63120000 Y=0.20120000 Z=0.30480000
          MULT= 4          ISPLIT=15
      -4: X=0.36880000 Y=0.79880000 Z=0.69520000
      -4: X=0.36880000 Y=0.29880000 Z=0.30480000
      -4: X=0.63120000 Y=0.70120000 Z=0.69520000
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=0.55160000 Y=0.00380000 Z=0.26520000
          MULT= 4          ISPLIT=15
      -5: X=0.44840000 Y=0.99620000 Z=0.73480000
      -5: X=0.44840000 Y=0.49620000 Z=0.26520000
      -5: X=0.55160000 Y=0.50380000 Z=0.73480000
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=0.69510000 Y=0.29610000 Z=0.30370000
          MULT= 4          ISPLIT=15
      -6: X=0.30490000 Y=0.70390000 Z=0.69630000
      -6: X=0.30490000 Y=0.20390000 Z=0.30370000
      -6: X=0.69510000 Y=0.79610000 Z=0.69630000
B          NPT=  781  R0=.000100000 RMT=   2.00000   Z:   5.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -7: X=0.63970000 Y=0.00620000 Z=0.18740000
          MULT= 4          ISPLIT=15
      -7: X=0.36030000 Y=0.99380000 Z=0.81260000
      -7: X=0.36030000 Y=0.49380000 Z=0.18740000
      -7: X=0.63970000 Y=0.50620000 Z=0.81260000
B          NPT=  781  R0=.000100000 RMT=   2.00000   Z:   5.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000