P   LATTICE,NONEQUIV.ATOMS   7   55 Pbam                                       
MODE OF CALC=RELA unit=bohr                                                    
 22.355460 25.781534  7.787561 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.12260000 Y=0.23910000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -1: X=0.87740000 Y=0.76090000 Z=0.00000000
      -1: X=0.37740000 Y=0.73910000 Z=0.00000000
      -1: X=0.62260000 Y=0.26090000 Z=0.00000000
Ca         NPT=  781  R0=.000050000 RMT= 2.50000     Z:  20.00000              
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
Ca         NPT=  781  R0=.000050000 RMT= 2.50000     Z:  20.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.37180000 Y=0.06710000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -3: X=0.62820000 Y=0.93290000 Z=0.00000000
      -3: X=0.12820000 Y=0.56710000 Z=0.00000000
      -3: X=0.87180000 Y=0.43290000 Z=0.00000000
Ca         NPT=  781  R0=.000050000 RMT= 2.50000     Z:  20.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.28480000 Y=0.39330000 Z=0.50000000
          MULT= 4          ISPLIT= 8
      -4: X=0.71520000 Y=0.60670000 Z=0.50000000
      -4: X=0.21520000 Y=0.89330000 Z=0.50000000
      -4: X=0.78480000 Y=0.10670000 Z=0.50000000
Sn         NPT=  781  R0=.000010000 RMT= 2.48        Z:  50.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.16960000 Y=0.08000000 Z=0.50000000
          MULT= 4          ISPLIT= 8
      -5: X=0.83040000 Y=0.92000000 Z=0.50000000
      -5: X=0.33040000 Y=0.58000000 Z=0.50000000
      -5: X=0.66960000 Y=0.42000000 Z=0.50000000
As         NPT=  781  R0=.000050000 RMT= 2.36        Z:  33.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.06750000 Y=0.38720000 Z=0.50000000
          MULT= 4          ISPLIT= 8
      -6: X=0.93250000 Y=0.61280000 Z=0.50000000
      -6: X=0.43250000 Y=0.88720000 Z=0.50000000
      -6: X=0.56750000 Y=0.11280000 Z=0.50000000
As         NPT=  781  R0=.000050000 RMT= 2.36        Z:  33.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -7: X=0.37290000 Y=0.29970000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -7: X=0.62710000 Y=0.70030000 Z=0.00000000
      -7: X=0.12710000 Y=0.79970000 Z=0.00000000
      -7: X=0.87290000 Y=0.20030000 Z=0.00000000
As         NPT=  781  R0=.000050000 RMT= 2.36        Z:  33.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000