CXZ LATTICE,NONEQUIV.ATOMS   6   15 B2/b                                       
MODE OF CALC=RELA unit=bohr                                                    
 18.502309  9.885157 17.120919 90.000000 90.000000 70.100000                   
ATOM  -1: X=0.00000000 Y=0.25000000 Z=0.41667000
          MULT= 2          ISPLIT= 8
      -1: X=0.00000000 Y=0.75000000 Z=0.58333000
Ti         NPT=  781  R0=.000050000 RMT= 2.11        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=0.25000000 Z=0.75000000
          MULT= 2          ISPLIT= 8
      -2: X=0.00000000 Y=0.75000000 Z=0.25000000
Na         NPT=  781  R0=.000100000 RMT= 2.01        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=0.80810000 Y=0.22070000 Z=0.08333000
          MULT= 4          ISPLIT= 8
      -3: X=0.19190000 Y=0.77930000 Z=0.91667000
      -3: X=0.19190000 Y=0.27930000 Z=0.08333000
      -3: X=0.80810000 Y=0.72070000 Z=0.91667000
Si         NPT=  781  R0=.000100000 RMT= 1.39        Z:  14.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.63390000 Y=0.33150000 Z=0.08333000
          MULT= 4          ISPLIT= 8
      -4: X=0.36610000 Y=0.66850000 Z=0.91667000
      -4: X=0.36610000 Y=0.16850000 Z=0.08333000
      -4: X=0.63390000 Y=0.83150000 Z=0.91667000
O          NPT=  781  R0=.000100000 RMT= 1.62        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=0.86610000 Y=0.16850000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -5: X=0.13390000 Y=0.83150000 Z=0.75000000
      -5: X=0.13390000 Y=0.33150000 Z=0.25000000
      -5: X=0.86610000 Y=0.66850000 Z=0.75000000
O          NPT=  781  R0=.000100000 RMT= 1.62        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=0.86610000 Y=0.44140000 Z=0.00760000
          MULT= 4          ISPLIT= 8
      -6: X=0.13390000 Y=0.55860000 Z=0.99240000
      -6: X=0.13390000 Y=0.05860000 Z=0.00760000
      -6: X=0.86610000 Y=0.94140000 Z=0.99240000
O          NPT=  781  R0=.000100000 RMT= 1.62        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000