P   LATTICE,NONEQUIV.ATOMS   9   59 Pmmn                                       
MODE OF CALC=RELA unit=bohr                                                    
 13.584485 31.763084 12.238244 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.25000000 Y=0.04390000 Z=0.88060000
          MULT= 4          ISPLIT= 8
      -1: X=0.75000000 Y=0.95610000 Z=0.11940000
      -1: X=0.75000000 Y=0.54390000 Z=0.11940000
      -1: X=0.25000000 Y=0.45610000 Z=0.88060000
Hg         NPT=  781  R0=.000005000 RMT= 2.50000     Z:  80.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -2: X=0.25000000 Y=0.75000000 Z=0.70080000
          MULT= 2          ISPLIT= 8
      -2: X=0.75000000 Y=0.25000000 Z=0.29920000
Hg         NPT=  781  R0=.000005000 RMT= 2.50000     Z:  80.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.25000000 Y=0.51230000 Z=0.47010000
          MULT= 4          ISPLIT= 8
      -3: X=0.75000000 Y=0.48770000 Z=0.52990000
      -3: X=0.75000000 Y=0.01230000 Z=0.52990000
      -3: X=0.25000000 Y=0.98770000 Z=0.47010000
Pd         NPT=  781  R0=.000010000 RMT= 2.38        Z:  46.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -4: X=0.00890000 Y=0.16130000 Z=0.03810000
          MULT= 8          ISPLIT= 8
      -4: X=0.99110000 Y=0.83870000 Z=0.96190000
      -4: X=0.50890000 Y=0.66130000 Z=0.96190000
      -4: X=0.49110000 Y=0.33870000 Z=0.03810000
      -4: X=0.49110000 Y=0.16130000 Z=0.03810000
      -4: X=0.50890000 Y=0.83870000 Z=0.96190000
      -4: X=0.99110000 Y=0.66130000 Z=0.96190000
      -4: X=0.00890000 Y=0.33870000 Z=0.03810000
Pd         NPT=  781  R0=.000010000 RMT= 2.38        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  -5: X=0.25000000 Y=0.16410000 Z=0.60320000
          MULT= 4          ISPLIT= 8
      -5: X=0.75000000 Y=0.83590000 Z=0.39680000
      -5: X=0.75000000 Y=0.66410000 Z=0.39680000
      -5: X=0.25000000 Y=0.33590000 Z=0.60320000
Pd         NPT=  781  R0=.000010000 RMT= 2.38        Z:  46.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -6: X=0.01420000 Y=0.08950000 Z=0.38130000
          MULT= 8          ISPLIT= 8
      -6: X=0.98580000 Y=0.91050000 Z=0.61870000
      -6: X=0.51420000 Y=0.58950000 Z=0.61870000
      -6: X=0.48580000 Y=0.41050000 Z=0.38130000
      -6: X=0.48580000 Y=0.08950000 Z=0.38130000
      -6: X=0.51420000 Y=0.91050000 Z=0.61870000
      -6: X=0.98580000 Y=0.58950000 Z=0.61870000
      -6: X=0.01420000 Y=0.41050000 Z=0.38130000
Se         NPT=  781  R0=.000050000 RMT= 2.27        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=0.25000000 Y=0.58220000 Z=0.11000000
          MULT= 4          ISPLIT= 8
      -7: X=0.75000000 Y=0.41780000 Z=0.89000000
      -7: X=0.75000000 Y=0.08220000 Z=0.89000000
      -7: X=0.25000000 Y=0.91780000 Z=0.11000000
Se         NPT=  781  R0=.000050000 RMT= 2.27        Z:  34.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -8: X=0.51010000 Y=0.25000000 Z=0.72590000
          MULT= 4          ISPLIT= 8
      -8: X=0.48990000 Y=0.75000000 Z=0.27410000
      -8: X=0.01010000 Y=0.75000000 Z=0.27410000
      -8: X=0.98990000 Y=0.25000000 Z=0.72590000
Se         NPT=  781  R0=.000050000 RMT= 2.27        Z:  34.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -9: X=0.25000000 Y=0.25000000 Z=0.19200000
          MULT= 2          ISPLIT= 8
      -9: X=0.75000000 Y=0.75000000 Z=0.80800000
Se         NPT=  781  R0=.000050000 RMT= 2.27        Z:  34.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000