B   LATTICE,NONEQUIV.ATOMS   3  199 I213                                       
MODE OF CALC=RELA unit=bohr                                                    
 15.502179 15.502179 15.502179 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00900000 Y=0.00900000 Z=0.00900000
          MULT= 4          ISPLIT= 4
      -1: X=0.99100000 Y=0.49100000 Z=0.00900000
      -1: X=0.00900000 Y=0.99100000 Z=0.49100000
      -1: X=0.99100000 Y=0.50900000 Z=0.49100000
Pb         NPT=  781  R0=.000005000 RMT= 2.50000     Z:  82.00000              
LOCAL ROT MATRIX:    0.7071068 0.4082483 0.5773503
                    -0.7071068 0.4082483 0.5773503
                     0.0000000-0.8164966 0.5773503
ATOM  -2: X=0.26400000 Y=0.00000000 Z=0.25000000
          MULT= 6          ISPLIT= 8
      -2: X=0.73600000 Y=0.50000000 Z=0.25000000
      -2: X=0.25000000 Y=0.26400000 Z=0.00000000
      -2: X=0.75000000 Y=0.23600000 Z=0.00000000
      -2: X=0.00000000 Y=0.25000000 Z=0.26400000
      -2: X=0.00000000 Y=0.75000000 Z=0.23600000
Pd         NPT=  781  R0=.000010000 RMT= 2.39        Z:  46.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -3: X=0.27960000 Y=0.27960000 Z=0.27960000
          MULT= 4          ISPLIT= 4
      -3: X=0.72040000 Y=0.22040000 Z=0.27960000
      -3: X=0.27960000 Y=0.72040000 Z=0.22040000
      -3: X=0.72040000 Y=0.77960000 Z=0.22040000
S          NPT=  781  R0=.000100000 RMT= 1.95        Z:  16.00000              
LOCAL ROT MATRIX:    0.7071068 0.4082483 0.5773503
                    -0.7071068 0.4082483 0.5773503
                     0.0000000-0.8164966 0.5773503