H   LATTICE,NONEQUIV.ATOMS   9  174 P-6                                        
MODE OF CALC=RELA unit=bohr                                                    
 19.570004 19.570004  7.601234 90.000000 90.000000120.000000                   
ATOM  -1: X=0.04020000 Y=0.42470000 Z=0.50000000
          MULT= 3          ISPLIT= 8
      -1: X=0.38450000 Y=0.95980000 Z=0.50000000
      -1: X=0.57530000 Y=0.61550000 Z=0.50000000
F          NPT=  781  R0=.000100000 RMT= 2.10        Z:   9.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.21090000 Y=0.12710000 Z=0.50000000
          MULT= 3          ISPLIT= 8
      -2: X=0.91620000 Y=0.78910000 Z=0.50000000
      -2: X=0.87290000 Y=0.08380000 Z=0.50000000
F          NPT=  781  R0=.000100000 RMT= 2.10        Z:   9.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.28840000 Y=0.39550000 Z=0.50000000
          MULT= 3          ISPLIT= 8
      -3: X=0.10710000 Y=0.71160000 Z=0.50000000
      -3: X=0.60450000 Y=0.89290000 Z=0.50000000
Pb         NPT=  781  R0=.000005000 RMT= 2.44        Z:  82.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.11590000 Y=0.27600000 Z=0.00000000
          MULT= 3          ISPLIT= 8
      -4: X=0.16010000 Y=0.88410000 Z=0.00000000
      -4: X=0.72400000 Y=0.83990000 Z=0.00000000
F          NPT=  781  R0=.000100000 RMT= 2.10        Z:   9.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.41010000 Y=0.10030000 Z=0.00000000
          MULT= 3          ISPLIT= 8
      -5: X=0.69020000 Y=0.58990000 Z=0.00000000
      -5: X=0.89970000 Y=0.30980000 Z=0.00000000
Pb         NPT=  781  R0=.000005000 RMT= 2.44        Z:  82.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.43100000 Y=0.38470000 Z=0.00000000
          MULT= 3          ISPLIT= 8
      -6: X=0.95370000 Y=0.56900000 Z=0.00000000
      -6: X=0.61530000 Y=0.04630000 Z=0.00000000
F          NPT=  781  R0=.000100000 RMT= 2.10        Z:   9.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -7: X=0.33333333 Y=0.66666667 Z=0.00000000
          MULT= 1          ISPLIT= 4
Br         NPT=  781  R0=.000050000 RMT= 2.50000     Z:  35.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -8: X=0.66666667 Y=0.33333333 Z=0.50000000
          MULT= 1          ISPLIT= 4
Br         NPT=  781  R0=.000050000 RMT= 2.50000     Z:  35.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -9: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 1          ISPLIT= 4
Pb         NPT=  781  R0=.000005000 RMT= 2.44        Z:  82.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000