P   LATTICE,NONEQUIV.ATOMS   6   62 Pnma    
MODE OF CALC=RELA unit=bohr
 22.786318 16.072121 14.586796 90.000000 90.000000 90.000000
ATOM  -1: X=0.32200000 Y=0.00300000 Z=0.02500000
          MULT= 8          ISPLIT=15
      -1: X=0.67800000 Y=0.99700000 Z=0.97500000
      -1: X=0.82200000 Y=0.00300000 Z=0.47500000
      -1: X=0.17800000 Y=0.99700000 Z=0.52500000
      -1: X=0.17800000 Y=0.50300000 Z=0.52500000
      -1: X=0.82200000 Y=0.49700000 Z=0.47500000
      -1: X=0.67800000 Y=0.50300000 Z=0.97500000
      -1: X=0.32200000 Y=0.49700000 Z=0.02500000
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  -2: X=0.00600000 Y=0.25000000 Z=0.07400000
          MULT= 4          ISPLIT=15
      -2: X=0.99400000 Y=0.75000000 Z=0.92600000
      -2: X=0.50600000 Y=0.25000000 Z=0.42600000
      -2: X=0.49400000 Y=0.75000000 Z=0.57400000
Zr         NPT=  781  R0=.000010000 RMT=   2.00000   Z:  40.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.09200000 Y=0.53700000 Z=0.16300000
          MULT= 8          ISPLIT=15
      -3: X=0.90800000 Y=0.46300000 Z=0.83700000
      -3: X=0.59200000 Y=0.53700000 Z=0.33700000
      -3: X=0.40800000 Y=0.46300000 Z=0.66300000
      -3: X=0.40800000 Y=0.03700000 Z=0.66300000
      -3: X=0.59200000 Y=0.96300000 Z=0.33700000
      -3: X=0.90800000 Y=0.03700000 Z=0.83700000
      -3: X=0.09200000 Y=0.96300000 Z=0.16300000
Se         NPT=  781  R0=.000050000 RMT=   2.00000   Z:  34.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.18200000 Y=0.25000000 Z=0.83300000
          MULT= 4          ISPLIT=15
      -4: X=0.81800000 Y=0.75000000 Z=0.16700000
      -4: X=0.68200000 Y=0.25000000 Z=0.66700000
      -4: X=0.31800000 Y=0.75000000 Z=0.33300000
Se         NPT=  781  R0=.000050000 RMT=   2.00000   Z:  34.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.00300000 Y=0.25000000 Z=0.44800000
          MULT= 4          ISPLIT=15
      -5: X=0.99700000 Y=0.75000000 Z=0.55200000
      -5: X=0.50300000 Y=0.25000000 Z=0.05200000
      -5: X=0.49700000 Y=0.75000000 Z=0.94800000
Se         NPT=  781  R0=.000050000 RMT=   2.00000   Z:  34.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.29200000 Y=0.25000000 Z=0.31300000
          MULT= 4          ISPLIT=15
      -6: X=0.70800000 Y=0.75000000 Z=0.68700000
      -6: X=0.79200000 Y=0.25000000 Z=0.18700000
      -6: X=0.20800000 Y=0.75000000 Z=0.81300000
Se         NPT=  781  R0=.000050000 RMT=   2.00000   Z:  34.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000