P   LATTICE,NONEQUIV.ATOMS   7   55 Pbam                                       
MODE OF CALC=RELA unit=bohr                                                    
 22.877025 26.495850  8.413061 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.15560000 Y=0.09630000 Z=0.50000000
          MULT= 4          ISPLIT= 8
      -1: X=0.84440000 Y=0.90370000 Z=0.50000000
      -1: X=0.34440000 Y=0.59630000 Z=0.50000000
      -1: X=0.65560000 Y=0.40370000 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=0.33900000 Y=0.32140000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -2: X=0.66100000 Y=0.67860000 Z=0.00000000
      -2: X=0.16100000 Y=0.82140000 Z=0.00000000
      -2: X=0.83900000 Y=0.17860000 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=0.02390000 Y=0.40070000 Z=0.50000000
          MULT= 4          ISPLIT= 8
      -3: X=0.97610000 Y=0.59930000 Z=0.50000000
      -3: X=0.47610000 Y=0.90070000 Z=0.50000000
      -3: X=0.52390000 Y=0.09930000 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=0.32540000 Y=0.01520000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -4: X=0.67460000 Y=0.98480000 Z=0.00000000
      -4: X=0.17460000 Y=0.51520000 Z=0.00000000
      -4: X=0.82540000 Y=0.48480000 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=0.09110000 Y=0.24760000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -5: X=0.90890000 Y=0.75240000 Z=0.00000000
      -5: X=0.40890000 Y=0.74760000 Z=0.00000000
      -5: X=0.59110000 Y=0.25240000 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=0.32930000 Y=0.21200000 Z=0.50000000
          MULT= 4          ISPLIT= 8
      -7: X=0.67070000 Y=0.78800000 Z=0.50000000
      -7: X=0.17070000 Y=0.71200000 Z=0.50000000
      -7: X=0.82930000 Y=0.28800000 Z=0.50000000
Ga         NPT=  781  R0=.000050000 RMT= 2.43        Z:  31.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000