P   LATTICE,NONEQUIV.ATOMS   5   62 Pnma                                       
MODE OF CALC=RELA unit=bohr                                                    
 16.614472  7.547566 27.588112 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.42440000 Y=0.25000000 Z=0.67770000
          MULT= 4          ISPLIT= 8
      -1: X=0.57560000 Y=0.75000000 Z=0.32230000
      -1: X=0.92440000 Y=0.25000000 Z=0.82230000
      -1: X=0.07560000 Y=0.75000000 Z=0.17770000
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=0.17190000 Y=0.25000000 Z=0.44460000
          MULT= 4          ISPLIT= 8
      -2: X=0.82810000 Y=0.75000000 Z=0.55540000
      -2: X=0.67190000 Y=0.25000000 Z=0.05540000
      -2: X=0.32810000 Y=0.75000000 Z=0.94460000
Cd         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  48.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.29280000 Y=0.25000000 Z=0.28970000
          MULT= 4          ISPLIT= 8
      -3: X=0.70720000 Y=0.75000000 Z=0.71030000
      -3: X=0.79280000 Y=0.25000000 Z=0.21030000
      -3: X=0.20720000 Y=0.75000000 Z=0.78970000
Cl         NPT=  781  R0=.000100000 RMT= 2.17        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=0.16520000 Y=0.25000000 Z=0.01060000
          MULT= 4          ISPLIT= 8
      -4: X=0.83480000 Y=0.75000000 Z=0.98940000
      -4: X=0.66520000 Y=0.25000000 Z=0.48940000
      -4: X=0.33480000 Y=0.75000000 Z=0.51060000
Cl         NPT=  781  R0=.000100000 RMT= 2.17        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  -5: X=0.02180000 Y=0.25000000 Z=0.60240000
          MULT= 4          ISPLIT= 8
      -5: X=0.97820000 Y=0.75000000 Z=0.39760000
      -5: X=0.52180000 Y=0.25000000 Z=0.89760000
      -5: X=0.47820000 Y=0.75000000 Z=0.10240000
Cl         NPT=  781  R0=.000100000 RMT= 2.17        Z:  17.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000