P   LATTICE,NONEQUIV.ATOMS   6   19 P212121                                    
MODE OF CALC=RELA unit=bohr                                                    
 12.005430 15.076235 16.348021 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.14280000 Y=0.09730000 Z=0.55270000
          MULT= 4          ISPLIT= 8
      -1: X=0.35720000 Y=0.90270000 Z=0.05270000
      -1: X=0.64280000 Y=0.40270000 Z=0.44730000
      -1: X=0.85720000 Y=0.59730000 Z=0.94730000
Se         NPT=  781  R0=.000050000 RMT= 1.65        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=0.26230000 Y=0.47690000 Z=0.14860000
          MULT= 4          ISPLIT= 8
      -2: X=0.23770000 Y=0.52310000 Z=0.64860000
      -2: X=0.76230000 Y=0.02310000 Z=0.85140000
      -2: X=0.73770000 Y=0.97690000 Z=0.35140000
Cl         NPT=  781  R0=.000100000 RMT= 2.27        Z:  17.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.34610000 Y=0.12110000 Z=0.04240000
          MULT= 4          ISPLIT= 8
      -3: X=0.15390000 Y=0.87890000 Z=0.54240000
      -3: X=0.84610000 Y=0.37890000 Z=0.95760000
      -3: X=0.65390000 Y=0.62110000 Z=0.45760000
O          NPT=  781  R0=.000100000 RMT= 1.49        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=0.36880000 Y=0.11280000 Z=0.65080000
          MULT= 4          ISPLIT= 8
      -4: X=0.13120000 Y=0.88720000 Z=0.15080000
      -4: X=0.86880000 Y=0.38720000 Z=0.34920000
      -4: X=0.63120000 Y=0.61280000 Z=0.84920000
O          NPT=  781  R0=.000100000 RMT= 1.49        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=0.22830000 Y=0.15440000 Z=0.37310000
          MULT= 4          ISPLIT= 8
      -5: X=0.27170000 Y=0.84560000 Z=0.87310000
      -5: X=0.72830000 Y=0.34560000 Z=0.62690000
      -5: X=0.77170000 Y=0.65440000 Z=0.12690000
O          NPT=  781  R0=.000100000 RMT= 1.49        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  -6: X=0.04080000 Y=0.19051000 Z=0.17085000
          MULT= 4          ISPLIT= 8
      -6: X=0.45920000 Y=0.80949000 Z=0.67085000
      -6: X=0.54080000 Y=0.30949000 Z=0.82915000
      -6: X=0.95920000 Y=0.69051000 Z=0.32915000
Bi         NPT=  781  R0=.000005000 RMT= 2.21        Z:  83.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000