P   LATTICE,NONEQUIV.ATOMS   7   55 Pbam                                       
MODE OF CALC=RELA unit=bohr                                                    
 22.928047 26.939936  8.422509 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.15110000 Y=0.09330000 Z=0.50000000
          MULT= 4          ISPLIT= 8
      -1: X=0.84890000 Y=0.90670000 Z=0.50000000
      -1: X=0.34890000 Y=0.59330000 Z=0.50000000
      -1: X=0.65110000 Y=0.40670000 Z=0.50000000
Sb         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  51.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.33860000 Y=0.32840000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -2: X=0.66140000 Y=0.67160000 Z=0.00000000
      -2: X=0.16140000 Y=0.82840000 Z=0.00000000
      -2: X=0.83860000 Y=0.17160000 Z=0.00000000
Sb         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  51.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.03600000 Y=0.40440000 Z=0.50000000
          MULT= 4          ISPLIT= 8
      -3: X=0.96400000 Y=0.59560000 Z=0.50000000
      -3: X=0.46400000 Y=0.90440000 Z=0.50000000
      -3: X=0.53600000 Y=0.09560000 Z=0.50000000
Sb         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  51.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.32200000 Y=0.01420000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -4: X=0.67800000 Y=0.98580000 Z=0.00000000
      -4: X=0.17800000 Y=0.51420000 Z=0.00000000
      -4: X=0.82200000 Y=0.48580000 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  -5: X=0.09130000 Y=0.24800000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -5: X=0.90870000 Y=0.75200000 Z=0.00000000
      -5: X=0.40870000 Y=0.74800000 Z=0.00000000
      -5: X=0.59130000 Y=0.25200000 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  -6: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -6: 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  -7: X=0.33600000 Y=0.21380000 Z=0.50000000
          MULT= 4          ISPLIT= 8
      -7: X=0.66400000 Y=0.78620000 Z=0.50000000
      -7: X=0.16400000 Y=0.71380000 Z=0.50000000
      -7: X=0.83600000 Y=0.28620000 Z=0.50000000
In         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  49.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000