P   LATTICE,NONEQUIV.ATOMS   6   31 Pmn21                                      
MODE OF CALC=RELA unit=bohr                                                    
 14.621567 12.944246 12.035288 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.14745000 Z=0.62828000
          MULT= 2          ISPLIT= 8
      -1: X=0.50000000 Y=0.85255000 Z=0.12828000
Cd         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  48.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -2: X=0.00000000 Y=0.82613000 Z=0.12493000
          MULT= 2          ISPLIT= 8
      -2: X=0.50000000 Y=0.17387000 Z=0.62493000
Ge         NPT=  781  R0=.000050000 RMT= 2.23        Z:  32.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -3: X=0.24540000 Y=0.33110000 Z=0.12300000
          MULT= 4          ISPLIT= 8
      -3: X=0.25460000 Y=0.66890000 Z=0.62300000
      -3: X=0.75460000 Y=0.33110000 Z=0.12300000
      -3: X=0.74540000 Y=0.66890000 Z=0.62300000
Li         NPT=  781  R0=.000100000 RMT= 2.09        Z:   3.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.00000000 Y=0.13411000 Z=0.22826000
          MULT= 2          ISPLIT= 8
      -4: X=0.50000000 Y=0.86589000 Z=0.72826000
S          NPT=  781  R0=.000100000 RMT= 1.92        Z:  16.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -5: X=0.22929000 Y=0.66872000 Z=0.24624000
          MULT= 4          ISPLIT= 8
      -5: X=0.27071000 Y=0.33128000 Z=0.74624000
      -5: X=0.77071000 Y=0.66872000 Z=0.24624000
      -5: X=0.72929000 Y=0.33128000 Z=0.74624000
S          NPT=  781  R0=.000100000 RMT= 1.92        Z:  16.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.00000000 Y=0.80719000 Z=0.77892000
          MULT= 2          ISPLIT= 8
      -6: X=0.50000000 Y=0.19281000 Z=0.27892000
S          NPT=  781  R0=.000100000 RMT= 1.92        Z:  16.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000