CXZ LATTICE,NONEQUIV.ATOMS   6   15 B2/b                                       
MODE OF CALC=RELA unit=bohr                                                    
 16.502978 14.807894 10.818682 90.000000 90.000000 81.710000                   
ATOM  -1: X=0.00000000 Y=0.25000000 Z=0.32820000
          MULT= 2          ISPLIT= 8
      -1: X=0.00000000 Y=0.75000000 Z=0.67180000
Se         NPT=  781  R0=.000050000 RMT= 1.68        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=0.60760000 Y=0.05550000 Z=0.32480000
          MULT= 4          ISPLIT= 8
      -2: X=0.39240000 Y=0.94450000 Z=0.67520000
      -2: X=0.39240000 Y=0.44450000 Z=0.32480000
      -2: X=0.60760000 Y=0.55550000 Z=0.67520000
Li         NPT=  781  R0=.000100000 RMT= 1.62        Z:   3.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.70030000 Y=0.35440000 Z=0.16440000
          MULT= 4          ISPLIT= 8
      -3: X=0.29970000 Y=0.64560000 Z=0.83560000
      -3: X=0.29970000 Y=0.14560000 Z=0.16440000
      -3: X=0.70030000 Y=0.85440000 Z=0.83560000
Li         NPT=  781  R0=.000100000 RMT= 1.62        Z:   3.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.00000000 Y=0.25000000 Z=0.62850000
          MULT= 2          ISPLIT= 8
      -4: X=0.00000000 Y=0.75000000 Z=0.37150000
O          NPT=  781  R0=.000100000 RMT= 1.52        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=0.91140000 Y=0.42450000 Z=0.17720000
          MULT= 4          ISPLIT= 8
      -5: X=0.08860000 Y=0.57550000 Z=0.82280000
      -5: X=0.08860000 Y=0.07550000 Z=0.17720000
      -5: X=0.91140000 Y=0.92450000 Z=0.82280000
O          NPT=  781  R0=.000100000 RMT= 1.52        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=0.82260000 Y=0.15940000 Z=0.32880000
          MULT= 4          ISPLIT= 8
      -6: X=0.17740000 Y=0.84060000 Z=0.67120000
      -6: X=0.17740000 Y=0.34060000 Z=0.32880000
      -6: X=0.82260000 Y=0.65940000 Z=0.67120000
O          NPT=  781  R0=.000100000 RMT= 1.52        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000