P   LATTICE,NONEQUIV.ATOMS   5   85 P4/n                                       
MODE OF CALC=RELA unit=bohr                                                    
 15.835905 15.835905 14.154049 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.25000000 Y=0.25000000 Z=0.56030000
          MULT= 2          ISPLIT=-2
      -1: X=0.75000000 Y=0.75000000 Z=0.43970000
Zr         NPT=  781  R0=.000010000 RMT= 2.17        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  -2: X=0.03020000 Y=0.00610000 Z=0.23010000
          MULT= 8          ISPLIT= 8
      -2: X=0.96980000 Y=0.99390000 Z=0.76990000
      -2: X=0.49390000 Y=0.03020000 Z=0.23010000
      -2: X=0.50610000 Y=0.96980000 Z=0.76990000
      -2: X=0.46980000 Y=0.49390000 Z=0.23010000
      -2: X=0.53020000 Y=0.50610000 Z=0.76990000
      -2: X=0.00610000 Y=0.46980000 Z=0.23010000
      -2: X=0.99390000 Y=0.53020000 Z=0.76990000
I          NPT=  781  R0=.000010000 RMT= 1.83        Z:  53.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.15470000 Y=0.50220000 Z=0.05780000
          MULT= 8          ISPLIT= 8
      -3: X=0.84530000 Y=0.49780000 Z=0.94220000
      -3: X=0.99780000 Y=0.15470000 Z=0.05780000
      -3: X=0.00220000 Y=0.84530000 Z=0.94220000
      -3: X=0.34530000 Y=0.99780000 Z=0.05780000
      -3: X=0.65470000 Y=0.00220000 Z=0.94220000
      -3: X=0.50220000 Y=0.34530000 Z=0.05780000
      -3: X=0.49780000 Y=0.65470000 Z=0.94220000
O          NPT=  781  R0=.000100000 RMT= 1.58        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=0.17870000 Y=0.04040000 Z=0.71730000
          MULT= 8          ISPLIT= 8
      -4: X=0.82130000 Y=0.95960000 Z=0.28270000
      -4: X=0.45960000 Y=0.17870000 Z=0.71730000
      -4: X=0.54040000 Y=0.82130000 Z=0.28270000
      -4: X=0.32130000 Y=0.45960000 Z=0.71730000
      -4: X=0.67870000 Y=0.54040000 Z=0.28270000
      -4: X=0.04040000 Y=0.32130000 Z=0.71730000
      -4: X=0.95960000 Y=0.67870000 Z=0.28270000
O          NPT=  781  R0=.000100000 RMT= 1.58        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  -5: X=0.04300000 Y=0.15890000 Z=0.40710000
          MULT= 8          ISPLIT= 8
      -5: X=0.95700000 Y=0.84110000 Z=0.59290000
      -5: X=0.34110000 Y=0.04300000 Z=0.40710000
      -5: X=0.65890000 Y=0.95700000 Z=0.59290000
      -5: X=0.45700000 Y=0.34110000 Z=0.40710000
      -5: X=0.54300000 Y=0.65890000 Z=0.59290000
      -5: X=0.15890000 Y=0.45700000 Z=0.40710000
      -5: X=0.84110000 Y=0.54300000 Z=0.59290000
O          NPT=  781  R0=.000100000 RMT= 1.58        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000