P   LATTICE,NONEQUIV.ATOMS   6   62 Pnma                                       
MODE OF CALC=RELA unit=bohr                                                    
 18.361335 15.945509  8.988293 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.36590000 Y=0.25000000 Z=0.02020000
          MULT= 4          ISPLIT= 8
      -1: X=0.63410000 Y=0.75000000 Z=0.97980000
      -1: X=0.86590000 Y=0.25000000 Z=0.47980000
      -1: X=0.13410000 Y=0.75000000 Z=0.52020000
W          NPT=  781  R0=.000005000 RMT= 1.86        Z:  74.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -2: X=0.13350000 Y=0.10030000 Z=0.00510000
          MULT= 8          ISPLIT= 8
      -2: X=0.86650000 Y=0.89970000 Z=0.99490000
      -2: X=0.63350000 Y=0.10030000 Z=0.49490000
      -2: X=0.36650000 Y=0.89970000 Z=0.50510000
      -2: X=0.36650000 Y=0.60030000 Z=0.50510000
      -2: X=0.63350000 Y=0.39970000 Z=0.49490000
      -2: X=0.86650000 Y=0.60030000 Z=0.99490000
      -2: X=0.13350000 Y=0.39970000 Z=0.00510000
W          NPT=  781  R0=.000005000 RMT= 1.86        Z:  74.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.03300000 Y=0.58700000 Z=0.22900000
          MULT= 8          ISPLIT= 8
      -3: X=0.96700000 Y=0.41300000 Z=0.77100000
      -3: X=0.53300000 Y=0.58700000 Z=0.27100000
      -3: X=0.46700000 Y=0.41300000 Z=0.72900000
      -3: X=0.46700000 Y=0.08700000 Z=0.72900000
      -3: X=0.53300000 Y=0.91300000 Z=0.27100000
      -3: X=0.96700000 Y=0.08700000 Z=0.77100000
      -3: X=0.03300000 Y=0.91300000 Z=0.22900000
O          NPT=  781  R0=.000100000 RMT= 1.60        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=0.28300000 Y=0.07800000 Z=0.24100000
          MULT= 8          ISPLIT= 8
      -4: X=0.71700000 Y=0.92200000 Z=0.75900000
      -4: X=0.78300000 Y=0.07800000 Z=0.25900000
      -4: X=0.21700000 Y=0.92200000 Z=0.74100000
      -4: X=0.21700000 Y=0.57800000 Z=0.74100000
      -4: X=0.78300000 Y=0.42200000 Z=0.25900000
      -4: X=0.71700000 Y=0.57800000 Z=0.75900000
      -4: X=0.28300000 Y=0.42200000 Z=0.24100000
O          NPT=  781  R0=.000100000 RMT= 1.60        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=0.21200000 Y=0.25000000 Z=0.73200000
          MULT= 4          ISPLIT= 8
      -5: X=0.78800000 Y=0.75000000 Z=0.26800000
      -5: X=0.71200000 Y=0.25000000 Z=0.76800000
      -5: X=0.28800000 Y=0.75000000 Z=0.23200000
O          NPT=  781  R0=.000100000 RMT= 1.60        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -6: X=0.02600000 Y=0.25000000 Z=0.26100000
          MULT= 4          ISPLIT= 8
      -6: X=0.97400000 Y=0.75000000 Z=0.73900000
      -6: X=0.52600000 Y=0.25000000 Z=0.23900000
      -6: X=0.47400000 Y=0.75000000 Z=0.76100000
O          NPT=  781  R0=.000100000 RMT= 1.60        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000