P   LATTICE,NONEQUIV.ATOMS   5   62 Pnma                                       
MODE OF CALC=RELA unit=bohr                                                    
 17.009425 12.738644  9.265327 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -1: X=0.50000000 Y=0.00000000 Z=0.50000000
      -1: X=0.50000000 Y=0.50000000 Z=0.50000000
      -1: X=0.00000000 Y=0.50000000 Z=0.00000000
Mg         NPT=  781  R0=.000100000 RMT= 1.89        Z:  12.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.32000000 Y=0.25000000 Z=0.03700000
          MULT= 4          ISPLIT= 8
      -2: X=0.68000000 Y=0.75000000 Z=0.96300000
      -2: X=0.82000000 Y=0.25000000 Z=0.46300000
      -2: X=0.18000000 Y=0.75000000 Z=0.53700000
Se         NPT=  781  R0=.000050000 RMT= 1.49        Z:  34.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.37100000 Y=0.25000000 Z=0.71900000
          MULT= 4          ISPLIT= 8
      -3: X=0.62900000 Y=0.75000000 Z=0.28100000
      -3: X=0.87100000 Y=0.25000000 Z=0.78100000
      -3: X=0.12900000 Y=0.75000000 Z=0.21900000
O          NPT=  781  R0=.000100000 RMT= 1.35        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -4: X=0.13800000 Y=0.25000000 Z=0.05100000
          MULT= 4          ISPLIT= 8
      -4: X=0.86200000 Y=0.75000000 Z=0.94900000
      -4: X=0.63800000 Y=0.25000000 Z=0.44900000
      -4: X=0.36200000 Y=0.75000000 Z=0.55100000
O          NPT=  781  R0=.000100000 RMT= 1.35        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -5: X=0.37400000 Y=0.06200000 Z=0.17300000
          MULT= 8          ISPLIT= 8
      -5: X=0.62600000 Y=0.93800000 Z=0.82700000
      -5: X=0.87400000 Y=0.06200000 Z=0.32700000
      -5: X=0.12600000 Y=0.93800000 Z=0.67300000
      -5: X=0.12600000 Y=0.56200000 Z=0.67300000
      -5: X=0.87400000 Y=0.43800000 Z=0.32700000
      -5: X=0.62600000 Y=0.56200000 Z=0.82700000
      -5: X=0.37400000 Y=0.43800000 Z=0.17300000
O          NPT=  781  R0=.000100000 RMT= 1.35        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000