P   LATTICE,NONEQUIV.ATOMS   6   62 Pnma    
MODE OF CALC=RELA unit=bohr
 24.075489 16.749588 15.150690 90.000000 90.000000 90.000000
ATOM  -1: X=0.32875000 Y=0.50540000 Z=0.45190000
          MULT= 8          ISPLIT=15
      -1: X=0.67125000 Y=0.49460000 Z=0.54810000
      -1: X=0.82875000 Y=0.50540000 Z=0.04810000
      -1: X=0.17125000 Y=0.49460000 Z=0.95190000
      -1: X=0.17125000 Y=0.00540000 Z=0.95190000
      -1: X=0.82875000 Y=0.99460000 Z=0.04810000
      -1: X=0.67125000 Y=0.00540000 Z=0.54810000
      -1: X=0.32875000 Y=0.99460000 Z=0.45190000
K          NPT=  781  R0=.000050000 RMT=   2.00000   Z:  19.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.00680000 Y=0.25000000 Z=0.42224000
          MULT= 4          ISPLIT=15
      -2: X=0.99320000 Y=0.75000000 Z=0.57776000
      -2: X=0.50680000 Y=0.25000000 Z=0.07776000
      -2: X=0.49320000 Y=0.75000000 Z=0.92224000
La         NPT=  781  R0=.000010000 RMT=   2.00000   Z:  57.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.00650000 Y=0.25000000 Z=0.06890000
          MULT= 4          ISPLIT=15
      -3: X=0.99350000 Y=0.75000000 Z=0.93110000
      -3: X=0.50650000 Y=0.25000000 Z=0.43110000
      -3: X=0.49350000 Y=0.75000000 Z=0.56890000
Cl         NPT=  781  R0=.000100000 RMT=   2.00000   Z:  17.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.29110000 Y=0.25000000 Z=0.17010000
          MULT= 4          ISPLIT=15
      -4: X=0.70890000 Y=0.75000000 Z=0.82990000
      -4: X=0.79110000 Y=0.25000000 Z=0.32990000
      -4: X=0.20890000 Y=0.75000000 Z=0.67010000
Cl         NPT=  781  R0=.000100000 RMT=   2.00000   Z:  17.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.18280000 Y=0.25000000 Z=0.63380000
          MULT= 4          ISPLIT=15
      -5: X=0.81720000 Y=0.75000000 Z=0.36620000
      -5: X=0.68280000 Y=0.25000000 Z=0.86620000
      -5: X=0.31720000 Y=0.75000000 Z=0.13380000
Cl         NPT=  781  R0=.000100000 RMT=   2.00000   Z:  17.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.07990000 Y=0.54410000 Z=0.33370000
          MULT= 8          ISPLIT=15
      -6: X=0.92010000 Y=0.45590000 Z=0.66630000
      -6: X=0.57990000 Y=0.54410000 Z=0.16630000
      -6: X=0.42010000 Y=0.45590000 Z=0.83370000
      -6: X=0.42010000 Y=0.04410000 Z=0.83370000
      -6: X=0.57990000 Y=0.95590000 Z=0.16630000
      -6: X=0.92010000 Y=0.04410000 Z=0.66630000
      -6: X=0.07990000 Y=0.95590000 Z=0.33370000
Cl         NPT=  781  R0=.000100000 RMT=   2.00000   Z:  17.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000