P   LATTICE,NONEQUIV.ATOMS   8   51 Pmma                                       
MODE OF CALC=RELA unit=bohr                                                    
 32.200933 13.813898 13.246980 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.25000000 Y=0.50000000 Z=0.48970000
          MULT= 2          ISPLIT= 8
      -1: X=0.75000000 Y=0.50000000 Z=0.51030000
Cs         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  55.00000              
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=0.20860000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -2: X=0.00000000 Y=0.79140000 Z=0.00000000
      -2: X=0.50000000 Y=0.20860000 Z=0.00000000
      -2: X=0.50000000 Y=0.79140000 Z=0.00000000
Nb         NPT=  781  R0=.000010000 RMT= 2.42        Z:  41.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.64080000 Y=0.00000000 Z=0.11930000
          MULT= 4          ISPLIT= 8
      -3: X=0.35920000 Y=0.00000000 Z=0.88070000
      -3: X=0.14080000 Y=0.00000000 Z=0.88070000
      -3: X=0.85920000 Y=0.00000000 Z=0.11930000
Nb         NPT=  781  R0=.000010000 RMT= 2.42        Z:  41.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -4: X=0.57600000 Y=0.25140000 Z=0.32280000
          MULT= 8          ISPLIT= 8
      -4: X=0.42400000 Y=0.74860000 Z=0.67720000
      -4: X=0.07600000 Y=0.25140000 Z=0.67720000
      -4: X=0.92400000 Y=0.74860000 Z=0.32280000
      -4: X=0.92400000 Y=0.25140000 Z=0.32280000
      -4: X=0.07600000 Y=0.74860000 Z=0.67720000
      -4: X=0.42400000 Y=0.25140000 Z=0.67720000
      -4: X=0.57600000 Y=0.74860000 Z=0.32280000
Br         NPT=  781  R0=.000050000 RMT= 2.42        Z:  35.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.08660000 Y=0.00000000 Z=0.22480000
          MULT= 4          ISPLIT= 8
      -5: X=0.91340000 Y=0.00000000 Z=0.77520000
      -5: X=0.58660000 Y=0.00000000 Z=0.77520000
      -5: X=0.41340000 Y=0.00000000 Z=0.22480000
Br         NPT=  781  R0=.000050000 RMT= 2.42        Z:  35.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -6: X=0.08540000 Y=0.50000000 Z=0.13910000
          MULT= 4          ISPLIT= 8
      -6: X=0.91460000 Y=0.50000000 Z=0.86090000
      -6: X=0.58540000 Y=0.50000000 Z=0.86090000
      -6: X=0.41460000 Y=0.50000000 Z=0.13910000
Br         NPT=  781  R0=.000050000 RMT= 2.42        Z:  35.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -7: X=0.25000000 Y=0.23370000 Z=0.01220000
          MULT= 4          ISPLIT= 8
      -7: X=0.75000000 Y=0.76630000 Z=0.98780000
      -7: X=0.75000000 Y=0.23370000 Z=0.98780000
      -7: X=0.25000000 Y=0.76630000 Z=0.01220000
Br         NPT=  781  R0=.000050000 RMT= 2.42        Z:  35.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -8: X=0.25000000 Y=0.00000000 Z=0.58620000
          MULT= 2          ISPLIT= 8
      -8: X=0.75000000 Y=0.00000000 Z=0.41380000
Br         NPT=  781  R0=.000050000 RMT= 2.42        Z:  35.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000