P   LATTICE,NONEQUIV.ATOMS   5   62 Pnma                                       
MODE OF CALC=RELA unit=bohr                                                    
 17.838070  7.471599 29.053405 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.45020000 Y=0.25000000 Z=0.67640000
          MULT= 4          ISPLIT= 8
      -1: X=0.54980000 Y=0.75000000 Z=0.32360000
      -1: X=0.95020000 Y=0.25000000 Z=0.82360000
      -1: X=0.04980000 Y=0.75000000 Z=0.17640000
In         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  49.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -2: X=0.16190000 Y=0.25000000 Z=0.44570000
          MULT= 4          ISPLIT= 8
      -2: X=0.83810000 Y=0.75000000 Z=0.55430000
      -2: X=0.66190000 Y=0.25000000 Z=0.05430000
      -2: X=0.33810000 Y=0.75000000 Z=0.94570000
Mg         NPT=  781  R0=.000100000 RMT= 2.33        Z:  12.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.17380000 Y=0.25000000 Z=0.00210000
          MULT= 4          ISPLIT= 8
      -3: X=0.82620000 Y=0.75000000 Z=0.99790000
      -3: X=0.67380000 Y=0.25000000 Z=0.49790000
      -3: X=0.32620000 Y=0.75000000 Z=0.50210000
Br         NPT=  781  R0=.000050000 RMT= 2.50000     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  -4: X=0.27550000 Y=0.25000000 Z=0.29050000
          MULT= 4          ISPLIT= 8
      -4: X=0.72450000 Y=0.75000000 Z=0.70950000
      -4: X=0.77550000 Y=0.25000000 Z=0.20950000
      -4: X=0.22450000 Y=0.75000000 Z=0.79050000
Br         NPT=  781  R0=.000050000 RMT= 2.50000     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  -5: X=0.02280000 Y=0.25000000 Z=0.60080000
          MULT= 4          ISPLIT= 8
      -5: X=0.97720000 Y=0.75000000 Z=0.39920000
      -5: X=0.52280000 Y=0.25000000 Z=0.89920000
      -5: X=0.47720000 Y=0.75000000 Z=0.10080000
Br         NPT=  781  R0=.000050000 RMT= 2.50000     Z:  35.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000