B   LATTICE,NONEQUIV.ATOMS   4  199 I213                                       
MODE OF CALC=RELA unit=bohr                                                    
 18.691092 18.691092 18.691092 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.02729000 Y=0.09737000 Z=0.35969000
          MULT=12          ISPLIT= 8
      -1: X=0.97271000 Y=0.40263000 Z=0.35969000
      -1: X=0.02729000 Y=0.90263000 Z=0.14031000
      -1: X=0.35969000 Y=0.02729000 Z=0.09737000
      -1: X=0.97271000 Y=0.59737000 Z=0.14031000
      -1: X=0.64031000 Y=0.47271000 Z=0.09737000
      -1: X=0.35969000 Y=0.97271000 Z=0.40263000
      -1: X=0.64031000 Y=0.52729000 Z=0.40263000
      -1: X=0.09737000 Y=0.35969000 Z=0.02729000
      -1: X=0.90263000 Y=0.14031000 Z=0.02729000
      -1: X=0.09737000 Y=0.64031000 Z=0.47271000
      -1: X=0.90263000 Y=0.85969000 Z=0.47271000
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  -2: X=0.10554000 Y=0.50037000 Z=0.11338000
          MULT=12          ISPLIT= 8
      -2: X=0.89446000 Y=0.99963000 Z=0.11338000
      -2: X=0.10554000 Y=0.49963000 Z=0.38662000
      -2: X=0.11338000 Y=0.10554000 Z=0.50037000
      -2: X=0.89446000 Y=0.00037000 Z=0.38662000
      -2: X=0.88662000 Y=0.39446000 Z=0.50037000
      -2: X=0.11338000 Y=0.89446000 Z=0.99963000
      -2: X=0.88662000 Y=0.60554000 Z=0.99963000
      -2: X=0.50037000 Y=0.11338000 Z=0.10554000
      -2: X=0.49963000 Y=0.38662000 Z=0.10554000
      -2: X=0.50037000 Y=0.88662000 Z=0.39446000
      -2: X=0.49963000 Y=0.61338000 Z=0.39446000
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  -3: X=0.10693000 Y=0.00000000 Z=0.25000000
          MULT= 6          ISPLIT= 8
      -3: X=0.89307000 Y=0.50000000 Z=0.25000000
      -3: X=0.25000000 Y=0.10693000 Z=0.00000000
      -3: X=0.75000000 Y=0.39307000 Z=0.00000000
      -3: X=0.00000000 Y=0.25000000 Z=0.10693000
      -3: X=0.00000000 Y=0.75000000 Z=0.39307000
O          NPT=  781  R0=.000100000 RMT= 1.62        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -4: X=0.31189000 Y=0.00000000 Z=0.25000000
          MULT= 6          ISPLIT= 8
      -4: X=0.68811000 Y=0.50000000 Z=0.25000000
      -4: X=0.25000000 Y=0.31189000 Z=0.00000000
      -4: X=0.75000000 Y=0.18811000 Z=0.00000000
      -4: X=0.00000000 Y=0.25000000 Z=0.31189000
      -4: X=0.00000000 Y=0.75000000 Z=0.18811000
O          NPT=  781  R0=.000100000 RMT= 1.62        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000