P   LATTICE,NONEQUIV.ATOMS   4  114 P-421c                                     
MODE OF CALC=RELA unit=bohr                                                    
 18.209401 18.209401  9.977754 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.01250000 Y=0.22370000 Z=0.06300000
          MULT= 8          ISPLIT= 8
      -1: X=0.22370000 Y=0.98750000 Z=0.93700000
      -1: X=0.51250000 Y=0.27630000 Z=0.43700000
      -1: X=0.98750000 Y=0.77630000 Z=0.06300000
      -1: X=0.27630000 Y=0.48750000 Z=0.56300000
      -1: X=0.77630000 Y=0.01250000 Z=0.93700000
      -1: X=0.48750000 Y=0.72370000 Z=0.43700000
      -1: X=0.72370000 Y=0.51250000 Z=0.56300000
Se         NPT=  781  R0=.000050000 RMT= 1.52        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  -2: X=0.38060000 Y=0.39920000 Z=0.34410000
          MULT= 8          ISPLIT= 8
      -2: X=0.39920000 Y=0.61940000 Z=0.65590000
      -2: X=0.88060000 Y=0.10080000 Z=0.15590000
      -2: X=0.61940000 Y=0.60080000 Z=0.34410000
      -2: X=0.10080000 Y=0.11940000 Z=0.84410000
      -2: X=0.60080000 Y=0.38060000 Z=0.65590000
      -2: X=0.11940000 Y=0.89920000 Z=0.15590000
      -2: X=0.89920000 Y=0.88060000 Z=0.84410000
O          NPT=  781  R0=.000100000 RMT= 1.37        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  -3: X=0.33610000 Y=0.05480000 Z=0.10420000
          MULT= 8          ISPLIT= 8
      -3: X=0.05480000 Y=0.66390000 Z=0.89580000
      -3: X=0.83610000 Y=0.44520000 Z=0.39580000
      -3: X=0.66390000 Y=0.94520000 Z=0.10420000
      -3: X=0.44520000 Y=0.16390000 Z=0.60420000
      -3: X=0.94520000 Y=0.33610000 Z=0.89580000
      -3: X=0.16390000 Y=0.55480000 Z=0.39580000
      -3: X=0.55480000 Y=0.83610000 Z=0.60420000
O          NPT=  781  R0=.000100000 RMT= 1.37        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=0.09950000 Y=0.24290000 Z=0.30930000
          MULT= 8          ISPLIT= 8
      -4: X=0.24290000 Y=0.90050000 Z=0.69070000
      -4: X=0.59950000 Y=0.25710000 Z=0.19070000
      -4: X=0.90050000 Y=0.75710000 Z=0.30930000
      -4: X=0.25710000 Y=0.40050000 Z=0.80930000
      -4: X=0.75710000 Y=0.09950000 Z=0.69070000
      -4: X=0.40050000 Y=0.74290000 Z=0.19070000
      -4: X=0.74290000 Y=0.59950000 Z=0.80930000
O          NPT=  781  R0=.000100000 RMT= 1.37        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000