P   LATTICE,NONEQUIV.ATOMS   7   62 Pnma                                       
MODE OF CALC=RELA unit=bohr                                                    
 26.800096 17.400598 13.458630 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -1: X=0.50000000 Y=0.00000000 Z=0.50000000
      -1: X=0.50000000 Y=0.50000000 Z=0.50000000
      -1: X=0.00000000 Y=0.50000000 Z=0.00000000
Na         NPT=  781  R0=.000100000 RMT= 2.50000     Z:  11.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.04540000 Y=0.25000000 Z=0.50700000
          MULT= 4          ISPLIT= 8
      -2: X=0.95460000 Y=0.75000000 Z=0.49300000
      -2: X=0.54540000 Y=0.25000000 Z=0.99300000
      -2: X=0.45460000 Y=0.75000000 Z=0.00700000
Na         NPT=  781  R0=.000100000 RMT= 2.50000     Z:  11.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.23220000 Y=0.55270000 Z=0.36000000
          MULT= 8          ISPLIT= 8
      -3: X=0.76780000 Y=0.44730000 Z=0.64000000
      -3: X=0.73220000 Y=0.55270000 Z=0.14000000
      -3: X=0.26780000 Y=0.44730000 Z=0.86000000
      -3: X=0.26780000 Y=0.05270000 Z=0.86000000
      -3: X=0.73220000 Y=0.94730000 Z=0.14000000
      -3: X=0.76780000 Y=0.05270000 Z=0.64000000
      -3: X=0.23220000 Y=0.94730000 Z=0.36000000
Na         NPT=  781  R0=.000100000 RMT= 2.50000     Z:  11.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.33510000 Y=0.25000000 Z=0.28100000
          MULT= 4          ISPLIT= 8
      -4: X=0.66490000 Y=0.75000000 Z=0.71900000
      -4: X=0.83510000 Y=0.25000000 Z=0.21900000
      -4: X=0.16490000 Y=0.75000000 Z=0.78100000
Si         NPT=  781  R0=.000100000 RMT= 1.85        Z:  14.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -5: X=0.40450000 Y=0.05030000 Z=0.15950000
          MULT= 8          ISPLIT= 8
      -5: X=0.59550000 Y=0.94970000 Z=0.84050000
      -5: X=0.90450000 Y=0.05030000 Z=0.34050000
      -5: X=0.09550000 Y=0.94970000 Z=0.65950000
      -5: X=0.09550000 Y=0.55030000 Z=0.65950000
      -5: X=0.90450000 Y=0.44970000 Z=0.34050000
      -5: X=0.59550000 Y=0.55030000 Z=0.84050000
      -5: X=0.40450000 Y=0.44970000 Z=0.15950000
Se         NPT=  781  R0=.000050000 RMT= 2.38        Z:  34.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.18260000 Y=0.25000000 Z=0.18430000
          MULT= 4          ISPLIT= 8
      -6: X=0.81740000 Y=0.75000000 Z=0.81570000
      -6: X=0.68260000 Y=0.25000000 Z=0.31570000
      -6: X=0.31740000 Y=0.75000000 Z=0.68430000
Se         NPT=  781  R0=.000050000 RMT= 2.38        Z:  34.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -7: X=0.35900000 Y=0.25000000 Z=0.59310000
          MULT= 4          ISPLIT= 8
      -7: X=0.64100000 Y=0.75000000 Z=0.40690000
      -7: X=0.85900000 Y=0.25000000 Z=0.90690000
      -7: X=0.14100000 Y=0.75000000 Z=0.09310000
Se         NPT=  781  R0=.000050000 RMT= 2.38        Z:  34.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000