B   LATTICE,NONEQUIV.ATOMS   3  141 I41/amd 
MODE OF CALC=RELA unit=bohr
 13.218634 13.218634 11.833465 90.000000 90.000000 90.000000
ATOM  -1: X=0.00000000 Y=0.75000000 Z=0.12500000
          MULT= 2          ISPLIT=15
      -1: X=0.00000000 Y=0.25000000 Z=0.87500000
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=0.00000000 Y=0.25000000 Z=0.37500000
          MULT= 2          ISPLIT=15
      -2: X=0.00000000 Y=0.75000000 Z=0.62500000
Si         NPT=  781  R0=.000100000 RMT=   2.00000   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  -3: X=0.00000000 Y=0.07000000 Z=0.22200000
          MULT= 8          ISPLIT=15
      -3: X=0.00000000 Y=0.93000000 Z=0.77800000
      -3: X=0.18000000 Y=0.75000000 Z=0.47200000
      -3: X=0.32000000 Y=0.75000000 Z=0.02800000
      -3: X=0.00000000 Y=0.43000000 Z=0.22200000
      -3: X=0.00000000 Y=0.57000000 Z=0.77800000
      -3: X=0.32000000 Y=0.25000000 Z=0.97200000
      -3: X=0.18000000 Y=0.25000000 Z=0.52800000
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