P   LATTICE,NONEQUIV.ATOMS   5   62 Pnma                                       
MODE OF CALC=RELA unit=bohr                                                    
 16.358792 13.063488  9.131724 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.31743000 Y=0.25000000 Z=0.04191000
          MULT= 4          ISPLIT= 8
      -1: X=0.68257000 Y=0.75000000 Z=0.95809000
      -1: X=0.81743000 Y=0.25000000 Z=0.45809000
      -1: X=0.18257000 Y=0.75000000 Z=0.54191000
Cl         NPT=  781  R0=.000100000 RMT= 1.34        Z:  17.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -2: X=0.15011000 Y=0.25000000 Z=0.04670000
          MULT= 4          ISPLIT= 8
      -2: X=0.84989000 Y=0.75000000 Z=0.95330000
      -2: X=0.65011000 Y=0.25000000 Z=0.45330000
      -2: X=0.34989000 Y=0.75000000 Z=0.54670000
O          NPT=  781  R0=.000100000 RMT= 1.34        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  -3: X=0.37089000 Y=0.07929000 Z=0.17890000
          MULT= 8          ISPLIT= 8
      -3: X=0.62911000 Y=0.92071000 Z=0.82110000
      -3: X=0.87089000 Y=0.07929000 Z=0.32110000
      -3: X=0.12911000 Y=0.92071000 Z=0.67890000
      -3: X=0.12911000 Y=0.57929000 Z=0.67890000
      -3: X=0.87089000 Y=0.42071000 Z=0.32110000
      -3: X=0.62911000 Y=0.57929000 Z=0.82110000
      -3: X=0.37089000 Y=0.42071000 Z=0.17890000
O          NPT=  781  R0=.000100000 RMT= 1.34        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  -4: X=0.37100000 Y=0.25000000 Z=0.76050000
          MULT= 4          ISPLIT= 8
      -4: X=0.62900000 Y=0.75000000 Z=0.23950000
      -4: X=0.87100000 Y=0.25000000 Z=0.73950000
      -4: X=0.12900000 Y=0.75000000 Z=0.26050000
O          NPT=  781  R0=.000100000 RMT= 1.34        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=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -5: X=0.50000000 Y=0.00000000 Z=0.50000000
      -5: X=0.50000000 Y=0.50000000 Z=0.50000000
      -5: X=0.00000000 Y=0.50000000 Z=0.00000000
Li         NPT=  781  R0=.000100000 RMT= 1.68        Z:   3.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000