P   LATTICE,NONEQUIV.ATOMS   3   29 Pca21   
MODE OF CALC=RELA unit=bohr
  9.367372  5.482096 14.847578 90.000000 90.000000 90.000000
ATOM  -1: X=0.25000000 Y=0.29700000 Z=0.08000000
          MULT= 4          ISPLIT=15
      -1: X=0.75000000 Y=0.70300000 Z=0.58000000
      -1: X=0.25000000 Y=0.29700000 Z=0.58000000
      -1: X=0.75000000 Y=0.70300000 Z=0.08000000
Re         NPT=  781  R0=.000005000 RMT=   2.00000   Z:  75.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.58000000 Y=0.20800000 Z=0.24200000
          MULT= 4          ISPLIT=15
      -2: X=0.42000000 Y=0.79200000 Z=0.74200000
      -2: X=0.92000000 Y=0.20800000 Z=0.74200000
      -2: X=0.08000000 Y=0.79200000 Z=0.24200000
N          NPT=  781  R0=.000100000 RMT=   2.00000   Z:   7.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.58000000 Y=0.20800000 Z=0.41800000
          MULT= 4          ISPLIT=15
      -3: X=0.42000000 Y=0.79200000 Z=0.91800000
      -3: X=0.92000000 Y=0.20800000 Z=0.91800000
      -3: X=0.08000000 Y=0.79200000 Z=0.41800000
N          NPT=  781  R0=.000100000 RMT=   2.00000   Z:   7.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000