P   LATTICE,NONEQUIV.ATOMS   4   62 Pnma                                       
MODE OF CALC=RELA unit=bohr                                                    
 13.173281 18.749863 13.141156 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.47100000 Y=0.25000000 Z=0.01200000
          MULT= 4          ISPLIT= 8
      -1: X=0.52900000 Y=0.75000000 Z=0.98800000
      -1: X=0.97100000 Y=0.25000000 Z=0.48800000
      -1: X=0.02900000 Y=0.75000000 Z=0.51200000
K          NPT=  781  R0=.000050000 RMT= 2.50000     Z:  19.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -2: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -2: X=0.50000000 Y=0.00000000 Z=0.50000000
      -2: X=0.50000000 Y=0.50000000 Z=0.50000000
      -2: X=0.00000000 Y=0.50000000 Z=0.00000000
Mg         NPT=  781  R0=.000100000 RMT= 2.35        Z:  12.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.50900000 Y=0.25000000 Z=0.54500000
          MULT= 4          ISPLIT= 8
      -3: X=0.49100000 Y=0.75000000 Z=0.45500000
      -3: X=0.00900000 Y=0.25000000 Z=0.95500000
      -3: X=0.99100000 Y=0.75000000 Z=0.04500000
Cl         NPT=  781  R0=.000100000 RMT= 2.35        Z:  17.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -4: X=0.21400000 Y=0.02520000 Z=0.28600000
          MULT= 8          ISPLIT= 8
      -4: X=0.78600000 Y=0.97480000 Z=0.71400000
      -4: X=0.71400000 Y=0.02520000 Z=0.21400000
      -4: X=0.28600000 Y=0.97480000 Z=0.78600000
      -4: X=0.28600000 Y=0.52520000 Z=0.78600000
      -4: X=0.71400000 Y=0.47480000 Z=0.21400000
      -4: X=0.78600000 Y=0.52520000 Z=0.71400000
      -4: X=0.21400000 Y=0.47480000 Z=0.28600000
Cl         NPT=  781  R0=.000100000 RMT= 2.35        Z:  17.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000