CXZ LATTICE,NONEQUIV.ATOMS   8   12 B2/m                                       
MODE OF CALC=RELA unit=bohr                                                    
 11.434733 33.181701 19.972516 90.000000 90.000000 88.790000                   
ATOM  -1: X=0.82200000 Y=0.16600000 Z=0.15800000
          MULT= 4          ISPLIT= 8
      -1: X=0.17800000 Y=0.83400000 Z=0.84200000
      -1: X=0.17800000 Y=0.83400000 Z=0.15800000
      -1: X=0.82200000 Y=0.16600000 Z=0.84200000
Ti         NPT=  781  R0=.000050000 RMT= 2.27        Z:  22.00000              
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=0.50000000 Z=0.34100000
          MULT= 2          ISPLIT= 8
      -2: X=0.00000000 Y=0.50000000 Z=0.65900000
Ti         NPT=  781  R0=.000050000 RMT= 2.27        Z:  22.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.96400000 Y=0.24300000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -3: X=0.03600000 Y=0.75700000 Z=0.00000000
Cl         NPT=  781  R0=.000100000 RMT= 2.05        Z:  17.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.66100000 Y=0.08800000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -4: X=0.33900000 Y=0.91200000 Z=0.00000000
Cl         NPT=  781  R0=.000100000 RMT= 2.05        Z:  17.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.63900000 Y=0.59200000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -5: X=0.36100000 Y=0.40800000 Z=0.00000000
Cl         NPT=  781  R0=.000100000 RMT= 2.05        Z:  17.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.82200000 Y=0.42800000 Z=0.16800000
          MULT= 4          ISPLIT= 8
      -6: X=0.17800000 Y=0.57200000 Z=0.83200000
      -6: X=0.17800000 Y=0.57200000 Z=0.16800000
      -6: X=0.82200000 Y=0.42800000 Z=0.83200000
Cl         NPT=  781  R0=.000100000 RMT= 2.05        Z:  17.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -7: X=0.63900000 Y=0.08400000 Z=0.31300000
          MULT= 4          ISPLIT= 8
      -7: X=0.36100000 Y=0.91600000 Z=0.68700000
      -7: X=0.36100000 Y=0.91600000 Z=0.31300000
      -7: X=0.63900000 Y=0.08400000 Z=0.68700000
Cl         NPT=  781  R0=.000100000 RMT= 2.05        Z:  17.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -8: X=0.99000000 Y=0.24300000 Z=0.32900000
          MULT= 4          ISPLIT= 8
      -8: X=0.01000000 Y=0.75700000 Z=0.67100000
      -8: X=0.01000000 Y=0.75700000 Z=0.32900000
      -8: X=0.99000000 Y=0.24300000 Z=0.67100000
Cl         NPT=  781  R0=.000100000 RMT= 2.05        Z:  17.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000