P   LATTICE,NONEQUIV.ATOMS   6   62 Pnma                                       
MODE OF CALC=RELA unit=bohr                                                    
 20.531874 16.605024 14.112475 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.01000000 Y=0.25000000 Z=0.03000000
          MULT= 4          ISPLIT= 8
      -1: X=0.99000000 Y=0.75000000 Z=0.97000000
      -1: X=0.51000000 Y=0.25000000 Z=0.47000000
      -1: X=0.49000000 Y=0.75000000 Z=0.53000000
Zr         NPT=  781  R0=.000010000 RMT= 2.29        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=0.27500000 Y=0.25000000 Z=0.19200000
          MULT= 4          ISPLIT= 8
      -2: X=0.72500000 Y=0.75000000 Z=0.80800000
      -2: X=0.77500000 Y=0.25000000 Z=0.30800000
      -2: X=0.22500000 Y=0.75000000 Z=0.69200000
Zr         NPT=  781  R0=.000010000 RMT= 2.29        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  -3: X=0.21300000 Y=0.25000000 Z=0.64800000
          MULT= 4          ISPLIT= 8
      -3: X=0.78700000 Y=0.75000000 Z=0.35200000
      -3: X=0.71300000 Y=0.25000000 Z=0.85200000
      -3: X=0.28700000 Y=0.75000000 Z=0.14800000
Zr         NPT=  781  R0=.000010000 RMT= 2.29        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  -4: X=0.05800000 Y=0.55400000 Z=0.30000000
          MULT= 8          ISPLIT= 8
      -4: X=0.94200000 Y=0.44600000 Z=0.70000000
      -4: X=0.55800000 Y=0.55400000 Z=0.20000000
      -4: X=0.44200000 Y=0.44600000 Z=0.80000000
      -4: X=0.44200000 Y=0.05400000 Z=0.80000000
      -4: X=0.55800000 Y=0.94600000 Z=0.20000000
      -4: X=0.94200000 Y=0.05400000 Z=0.70000000
      -4: X=0.05800000 Y=0.94600000 Z=0.30000000
Zr         NPT=  781  R0=.000010000 RMT= 2.29        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  -5: X=0.04300000 Y=0.25000000 Z=0.42200000
          MULT= 4          ISPLIT= 8
      -5: X=0.95700000 Y=0.75000000 Z=0.57800000
      -5: X=0.54300000 Y=0.25000000 Z=0.07800000
      -5: X=0.45700000 Y=0.75000000 Z=0.92200000
Sb         NPT=  781  R0=.000010000 RMT= 2.41        Z:  51.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -6: X=0.32400000 Y=0.50800000 Z=0.42900000
          MULT= 8          ISPLIT= 8
      -6: X=0.67600000 Y=0.49200000 Z=0.57100000
      -6: X=0.82400000 Y=0.50800000 Z=0.07100000
      -6: X=0.17600000 Y=0.49200000 Z=0.92900000
      -6: X=0.17600000 Y=0.00800000 Z=0.92900000
      -6: X=0.82400000 Y=0.99200000 Z=0.07100000
      -6: X=0.67600000 Y=0.00800000 Z=0.57100000
      -6: X=0.32400000 Y=0.99200000 Z=0.42900000
Sb         NPT=  781  R0=.000010000 RMT= 2.41        Z:  51.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000