H   LATTICE,NONEQUIV.ATOMS   6  190 P-62c                                      
MODE OF CALC=RELA unit=bohr                                                    
 16.862026 16.862026 33.075877 90.000000 90.000000120.000000                   
ATOM  -1: X=0.14426000 Y=0.50370000 Z=0.16631000
          MULT=12          ISPLIT= 8
      -1: X=0.35944000 Y=0.85574000 Z=0.33369000
      -1: X=0.50370000 Y=0.14426000 Z=0.66631000
      -1: X=0.49630000 Y=0.64056000 Z=0.16631000
      -1: X=0.64056000 Y=0.49630000 Z=0.83369000
      -1: X=0.14426000 Y=0.50370000 Z=0.33369000
      -1: X=0.85574000 Y=0.35944000 Z=0.66631000
      -1: X=0.35944000 Y=0.85574000 Z=0.16631000
      -1: X=0.50370000 Y=0.14426000 Z=0.83369000
      -1: X=0.49630000 Y=0.64056000 Z=0.33369000
      -1: X=0.64056000 Y=0.49630000 Z=0.66631000
      -1: X=0.85574000 Y=0.35944000 Z=0.83369000
W          NPT=  781  R0=.000005000 RMT= 2.28        Z:  74.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.58500000 Y=0.06520000 Z=0.25000000
          MULT= 6          ISPLIT= 8
      -2: X=0.48020000 Y=0.41500000 Z=0.25000000
      -2: X=0.06520000 Y=0.58500000 Z=0.75000000
      -2: X=0.93480000 Y=0.51980000 Z=0.25000000
      -2: X=0.51980000 Y=0.93480000 Z=0.75000000
      -2: X=0.41500000 Y=0.48020000 Z=0.75000000
Cl         NPT=  781  R0=.000100000 RMT= 2.05        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=0.10000000 Y=0.26750000 Z=0.25000000
          MULT= 6          ISPLIT= 8
      -3: X=0.16750000 Y=0.90000000 Z=0.25000000
      -3: X=0.26750000 Y=0.10000000 Z=0.75000000
      -3: X=0.73250000 Y=0.83250000 Z=0.25000000
      -3: X=0.83250000 Y=0.73250000 Z=0.75000000
      -3: X=0.90000000 Y=0.16750000 Z=0.75000000
Cl         NPT=  781  R0=.000100000 RMT= 2.05        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  -4: X=0.39300000 Y=0.10530000 Z=0.10200000
          MULT=12          ISPLIT= 8
      -4: X=0.71230000 Y=0.60700000 Z=0.39800000
      -4: X=0.10530000 Y=0.39300000 Z=0.60200000
      -4: X=0.89470000 Y=0.28770000 Z=0.10200000
      -4: X=0.28770000 Y=0.89470000 Z=0.89800000
      -4: X=0.39300000 Y=0.10530000 Z=0.39800000
      -4: X=0.60700000 Y=0.71230000 Z=0.60200000
      -4: X=0.71230000 Y=0.60700000 Z=0.10200000
      -4: X=0.10530000 Y=0.39300000 Z=0.89800000
      -4: X=0.89470000 Y=0.28770000 Z=0.39800000
      -4: X=0.28770000 Y=0.89470000 Z=0.60200000
      -4: X=0.60700000 Y=0.71230000 Z=0.89800000
Cl         NPT=  781  R0=.000100000 RMT= 2.05        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  -5: X=0.30300000 Y=0.43870000 Z=0.07720000
          MULT=12          ISPLIT= 8
      -5: X=0.13570000 Y=0.69700000 Z=0.42280000
      -5: X=0.43870000 Y=0.30300000 Z=0.57720000
      -5: X=0.56130000 Y=0.86430000 Z=0.07720000
      -5: X=0.86430000 Y=0.56130000 Z=0.92280000
      -5: X=0.30300000 Y=0.43870000 Z=0.42280000
      -5: X=0.69700000 Y=0.13570000 Z=0.57720000
      -5: X=0.13570000 Y=0.69700000 Z=0.07720000
      -5: X=0.43870000 Y=0.30300000 Z=0.92280000
      -5: X=0.56130000 Y=0.86430000 Z=0.42280000
      -5: X=0.86430000 Y=0.56130000 Z=0.57720000
      -5: X=0.69700000 Y=0.13570000 Z=0.92280000
Cl         NPT=  781  R0=.000100000 RMT= 2.05        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  -6: X=0.33333333 Y=0.66666667 Z=0.25000000
          MULT= 2          ISPLIT= 4
      -6: X=0.66666667 Y=0.33333333 Z=0.75000000
C          NPT=  781  R0=.000100000 RMT= 1.77        Z:   6.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000