P   LATTICE,NONEQUIV.ATOMS   6   60 Pbcn                                       
MODE OF CALC=RELA unit=bohr                                                    
 17.281545 15.987083  9.165172 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.58300000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -1: X=0.00000000 Y=0.41700000 Z=0.75000000
      -1: X=0.50000000 Y=0.08300000 Z=0.25000000
      -1: X=0.50000000 Y=0.91700000 Z=0.75000000
Mg         NPT=  781  R0=.000100000 RMT= 1.86        Z:  12.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -2: X=0.00000000 Y=0.25000000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -2: X=0.00000000 Y=0.75000000 Z=0.75000000
      -2: X=0.50000000 Y=0.75000000 Z=0.25000000
      -2: X=0.50000000 Y=0.25000000 Z=0.75000000
Mg         NPT=  781  R0=.000100000 RMT= 1.86        Z:  12.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.18800000 Y=0.08300000 Z=0.41700000
          MULT= 8          ISPLIT= 8
      -3: X=0.81200000 Y=0.91700000 Z=0.58300000
      -3: X=0.68800000 Y=0.58300000 Z=0.08300000
      -3: X=0.31200000 Y=0.41700000 Z=0.91700000
      -3: X=0.31200000 Y=0.58300000 Z=0.41700000
      -3: X=0.68800000 Y=0.41700000 Z=0.58300000
      -3: X=0.81200000 Y=0.08300000 Z=0.08300000
      -3: X=0.18800000 Y=0.91700000 Z=0.91700000
Si         NPT=  781  R0=.000100000 RMT= 1.49        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=0.12500000 Y=0.41700000 Z=0.08300000
          MULT= 8          ISPLIT= 8
      -4: X=0.87500000 Y=0.58300000 Z=0.91700000
      -4: X=0.62500000 Y=0.91700000 Z=0.41700000
      -4: X=0.37500000 Y=0.08300000 Z=0.58300000
      -4: X=0.37500000 Y=0.91700000 Z=0.08300000
      -4: X=0.62500000 Y=0.08300000 Z=0.91700000
      -4: X=0.87500000 Y=0.41700000 Z=0.41700000
      -4: X=0.12500000 Y=0.58300000 Z=0.58300000
O          NPT=  781  R0=.000100000 RMT= 1.73        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=0.37500000 Y=0.25000000 Z=0.08300000
          MULT= 8          ISPLIT= 8
      -5: X=0.62500000 Y=0.75000000 Z=0.91700000
      -5: X=0.87500000 Y=0.75000000 Z=0.41700000
      -5: X=0.12500000 Y=0.25000000 Z=0.58300000
      -5: X=0.12500000 Y=0.75000000 Z=0.08300000
      -5: X=0.87500000 Y=0.25000000 Z=0.91700000
      -5: X=0.62500000 Y=0.25000000 Z=0.41700000
      -5: X=0.37500000 Y=0.75000000 Z=0.58300000
O          NPT=  781  R0=.000100000 RMT= 1.73        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=0.12500000 Y=0.08300000 Z=0.08300000
          MULT= 8          ISPLIT= 8
      -6: X=0.87500000 Y=0.91700000 Z=0.91700000
      -6: X=0.62500000 Y=0.58300000 Z=0.41700000
      -6: X=0.37500000 Y=0.41700000 Z=0.58300000
      -6: X=0.37500000 Y=0.58300000 Z=0.08300000
      -6: X=0.62500000 Y=0.41700000 Z=0.91700000
      -6: X=0.87500000 Y=0.08300000 Z=0.41700000
      -6: X=0.12500000 Y=0.91700000 Z=0.58300000
O          NPT=  781  R0=.000100000 RMT= 1.73        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000