P   LATTICE,NONEQUIV.ATOMS   5  198 P213                                       
MODE OF CALC=RELA unit=bohr                                                    
 20.015979 20.015979 20.015979 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.04700000 Y=0.25740000 Z=0.34690000
          MULT=12          ISPLIT= 8
      -1: X=0.45300000 Y=0.74260000 Z=0.84690000
      -1: X=0.54700000 Y=0.24260000 Z=0.65310000
      -1: X=0.34690000 Y=0.04700000 Z=0.25740000
      -1: X=0.95300000 Y=0.75740000 Z=0.15310000
      -1: X=0.15310000 Y=0.95300000 Z=0.75740000
      -1: X=0.84690000 Y=0.45300000 Z=0.74260000
      -1: X=0.65310000 Y=0.54700000 Z=0.24260000
      -1: X=0.25740000 Y=0.34690000 Z=0.04700000
      -1: X=0.24260000 Y=0.65310000 Z=0.54700000
      -1: X=0.75740000 Y=0.15310000 Z=0.95300000
      -1: X=0.74260000 Y=0.84690000 Z=0.45300000
Se         NPT=  781  R0=.000050000 RMT= 2.34        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=0.56420000 Y=0.56420000 Z=0.56420000
          MULT= 4          ISPLIT= 4
      -2: X=0.93580000 Y=0.43580000 Z=0.06420000
      -2: X=0.06420000 Y=0.93580000 Z=0.43580000
      -2: X=0.43580000 Y=0.06420000 Z=0.93580000
Cs         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  55.00000              
LOCAL ROT MATRIX:    0.7071068 0.4082483 0.5773503
                    -0.7071068 0.4082483 0.5773503
                     0.0000000-0.8164966 0.5773503
ATOM  -3: X=0.82220000 Y=0.82220000 Z=0.82220000
          MULT= 4          ISPLIT= 4
      -3: X=0.67780000 Y=0.17780000 Z=0.32220000
      -3: X=0.32220000 Y=0.67780000 Z=0.17780000
      -3: X=0.17780000 Y=0.32220000 Z=0.67780000
Cs         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  55.00000              
LOCAL ROT MATRIX:    0.7071068 0.4082483 0.5773503
                    -0.7071068 0.4082483 0.5773503
                     0.0000000-0.8164966 0.5773503
ATOM  -4: X=0.06100000 Y=0.06100000 Z=0.06100000
          MULT= 4          ISPLIT= 4
      -4: X=0.43900000 Y=0.93900000 Z=0.56100000
      -4: X=0.56100000 Y=0.43900000 Z=0.93900000
      -4: X=0.93900000 Y=0.56100000 Z=0.43900000
Cs         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  55.00000              
LOCAL ROT MATRIX:    0.7071068 0.4082483 0.5773503
                    -0.7071068 0.4082483 0.5773503
                     0.0000000-0.8164966 0.5773503
ATOM  -5: X=0.27690000 Y=0.27690000 Z=0.27690000
          MULT= 4          ISPLIT= 4
      -5: X=0.22310000 Y=0.72310000 Z=0.77690000
      -5: X=0.77690000 Y=0.22310000 Z=0.72310000
      -5: X=0.72310000 Y=0.77690000 Z=0.22310000
Sb         NPT=  781  R0=.000010000 RMT= 2.46        Z:  51.00000              
LOCAL ROT MATRIX:    0.7071068 0.4082483 0.5773503
                    -0.7071068 0.4082483 0.5773503
                     0.0000000-0.8164966 0.5773503