P   LATTICE,NONEQUIV.ATOMS   7   55 Pbam                                       
MODE OF CALC=RELA unit=bohr                                                    
 19.980074 28.485732  6.702859 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.21532000 Y=0.11591000 Z=0.50000000
          MULT= 4          ISPLIT= 8
      -1: X=0.78468000 Y=0.88409000 Z=0.50000000
      -1: X=0.28468000 Y=0.61591000 Z=0.50000000
      -1: X=0.71532000 Y=0.38409000 Z=0.50000000
Nb         NPT=  781  R0=.000010000 RMT= 2.40        Z:  41.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -2: X=0.50000000 Y=0.50000000 Z=0.00000000
Pd         NPT=  781  R0=.000010000 RMT= 2.33        Z:  46.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.38120000 Y=0.21616000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -3: X=0.61880000 Y=0.78384000 Z=0.00000000
      -3: X=0.11880000 Y=0.71616000 Z=0.00000000
      -3: X=0.88120000 Y=0.28384000 Z=0.00000000
Pd         NPT=  781  R0=.000010000 RMT= 2.33        Z:  46.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.26815000 Y=0.48891000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -4: X=0.73185000 Y=0.51109000 Z=0.00000000
      -4: X=0.23185000 Y=0.98891000 Z=0.00000000
      -4: X=0.76815000 Y=0.01109000 Z=0.00000000
Se         NPT=  781  R0=.000050000 RMT= 2.21        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  -5: X=0.04391000 Y=0.15734000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -5: X=0.95609000 Y=0.84266000 Z=0.00000000
      -5: X=0.45609000 Y=0.65734000 Z=0.00000000
      -5: X=0.54391000 Y=0.34266000 Z=0.00000000
Se         NPT=  781  R0=.000050000 RMT= 2.21        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  -6: X=0.25032000 Y=0.28335000 Z=0.50000000
          MULT= 4          ISPLIT= 8
      -6: X=0.74968000 Y=0.71665000 Z=0.50000000
      -6: X=0.24968000 Y=0.78335000 Z=0.50000000
      -6: X=0.75032000 Y=0.21665000 Z=0.50000000
Se         NPT=  781  R0=.000050000 RMT= 2.21        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  -7: X=0.45742000 Y=0.11562000 Z=0.50000000
          MULT= 4          ISPLIT= 8
      -7: X=0.54258000 Y=0.88438000 Z=0.50000000
      -7: X=0.04258000 Y=0.61562000 Z=0.50000000
      -7: X=0.95742000 Y=0.38438000 Z=0.50000000
Se         NPT=  781  R0=.000050000 RMT= 2.21        Z:  34.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000