P   LATTICE,NONEQUIV.ATOMS   3   62 Pnma                                       
MODE OF CALC=RELA unit=bohr                                                    
 12.851272  6.969877 17.069518 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.22644000 Y=0.25000000 Z=0.33804000
          MULT= 4          ISPLIT= 8
      -1: X=0.77356000 Y=0.75000000 Z=0.66196000
      -1: X=0.72644000 Y=0.25000000 Z=0.16196000
      -1: X=0.27356000 Y=0.75000000 Z=0.83804000
Zr         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  40.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -2: X=0.11820000 Y=0.25000000 Z=0.04210000
          MULT= 4          ISPLIT= 8
      -2: X=0.88180000 Y=0.75000000 Z=0.95790000
      -2: X=0.61820000 Y=0.25000000 Z=0.45790000
      -2: X=0.38180000 Y=0.75000000 Z=0.54210000
As         NPT=  781  R0=.000050000 RMT= 2.41        Z:  33.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.08332000 Y=0.25000000 Z=0.64704000
          MULT= 4          ISPLIT= 8
      -3: X=0.91668000 Y=0.75000000 Z=0.35296000
      -3: X=0.58332000 Y=0.25000000 Z=0.85296000
      -3: X=0.41668000 Y=0.75000000 Z=0.14704000
As         NPT=  781  R0=.000050000 RMT= 2.41        Z:  33.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000