P   LATTICE,NONEQUIV.ATOMS   7   62 Pnma                                       
MODE OF CALC=RELA unit=bohr                                                    
 18.496639  6.236096 20.511087 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.56850000 Y=0.25000000 Z=0.62580000
          MULT= 4          ISPLIT= 8
      -1: X=0.43150000 Y=0.75000000 Z=0.37420000
      -1: X=0.06850000 Y=0.25000000 Z=0.87420000
      -1: X=0.93150000 Y=0.75000000 Z=0.12580000
Zr         NPT=  781  R0=.000010000 RMT= 2.09        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=0.10820000 Y=0.25000000 Z=0.40700000
          MULT= 4          ISPLIT= 8
      -2: X=0.89180000 Y=0.75000000 Z=0.59300000
      -2: X=0.60820000 Y=0.25000000 Z=0.09300000
      -2: X=0.39180000 Y=0.75000000 Z=0.90700000
Zr         NPT=  781  R0=.000010000 RMT= 2.09        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=0.23270000 Y=0.25000000 Z=0.14690000
          MULT= 4          ISPLIT= 8
      -3: X=0.76730000 Y=0.75000000 Z=0.85310000
      -3: X=0.73270000 Y=0.25000000 Z=0.35310000
      -3: X=0.26730000 Y=0.75000000 Z=0.64690000
Zr         NPT=  781  R0=.000010000 RMT= 2.09        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=0.26300000 Y=0.25000000 Z=0.78530000
          MULT= 4          ISPLIT= 8
      -4: X=0.73700000 Y=0.75000000 Z=0.21470000
      -4: X=0.76300000 Y=0.25000000 Z=0.71470000
      -4: X=0.23700000 Y=0.75000000 Z=0.28530000
N          NPT=  781  R0=.000100000 RMT= 1.80        Z:   7.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -5: X=0.35490000 Y=0.25000000 Z=0.51850000
          MULT= 4          ISPLIT= 8
      -5: X=0.64510000 Y=0.75000000 Z=0.48150000
      -5: X=0.85490000 Y=0.25000000 Z=0.98150000
      -5: X=0.14510000 Y=0.75000000 Z=0.01850000
N          NPT=  781  R0=.000100000 RMT= 1.80        Z:   7.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -6: X=0.00490000 Y=0.25000000 Z=0.22580000
          MULT= 4          ISPLIT= 8
      -6: X=0.99510000 Y=0.75000000 Z=0.77420000
      -6: X=0.50490000 Y=0.25000000 Z=0.27420000
      -6: X=0.49510000 Y=0.75000000 Z=0.72580000
N          NPT=  781  R0=.000100000 RMT= 1.80        Z:   7.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -7: X=0.39780000 Y=0.25000000 Z=0.02730000
          MULT= 4          ISPLIT= 8
      -7: X=0.60220000 Y=0.75000000 Z=0.97270000
      -7: X=0.89780000 Y=0.25000000 Z=0.47270000
      -7: X=0.10220000 Y=0.75000000 Z=0.52730000
N          NPT=  781  R0=.000100000 RMT= 1.80        Z:   7.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000