P   LATTICE,NONEQUIV.ATOMS   4   60 Pbcn                                       
MODE OF CALC=RELA unit=bohr                                                    
 12.264134 29.052650 12.894924 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.37070000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -1: X=0.00000000 Y=0.62930000 Z=0.75000000
      -1: X=0.50000000 Y=0.87070000 Z=0.25000000
      -1: X=0.50000000 Y=0.12930000 Z=0.75000000
Ba         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  56.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -2: X=0.00000000 Y=0.10934000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -2: X=0.00000000 Y=0.89066000 Z=0.75000000
      -2: X=0.50000000 Y=0.60934000 Z=0.25000000
      -2: X=0.50000000 Y=0.39066000 Z=0.75000000
Zn         NPT=  781  R0=.000050000 RMT= 2.29        Z:  30.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.25510000 Y=0.03683000 Z=0.40850000
          MULT= 8          ISPLIT= 8
      -3: X=0.74490000 Y=0.96317000 Z=0.59150000
      -3: X=0.75510000 Y=0.53683000 Z=0.09150000
      -3: X=0.24490000 Y=0.46317000 Z=0.90850000
      -3: X=0.24490000 Y=0.53683000 Z=0.40850000
      -3: X=0.75510000 Y=0.46317000 Z=0.59150000
      -3: X=0.74490000 Y=0.03683000 Z=0.09150000
      -3: X=0.25510000 Y=0.96317000 Z=0.90850000
Cl         NPT=  781  R0=.000100000 RMT= 1.97        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=0.14680000 Y=0.20079000 Z=0.02340000
          MULT= 8          ISPLIT= 8
      -4: X=0.85320000 Y=0.79921000 Z=0.97660000
      -4: X=0.64680000 Y=0.70079000 Z=0.47660000
      -4: X=0.35320000 Y=0.29921000 Z=0.52340000
      -4: X=0.35320000 Y=0.70079000 Z=0.02340000
      -4: X=0.64680000 Y=0.29921000 Z=0.97660000
      -4: X=0.85320000 Y=0.20079000 Z=0.47660000
      -4: X=0.14680000 Y=0.79921000 Z=0.52340000
Cl         NPT=  781  R0=.000100000 RMT= 1.97        Z:  17.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000