P   LATTICE,NONEQUIV.ATOMS   6   62 Pnma                                       
MODE OF CALC=RELA unit=bohr                                                    
 28.020859 16.176056 13.251327 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -1: X=0.50000000 Y=0.00000000 Z=0.50000000
      -1: X=0.50000000 Y=0.50000000 Z=0.50000000
      -1: X=0.00000000 Y=0.50000000 Z=0.00000000
Li         NPT=  781  R0=.000100000 RMT= 2.28        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  -2: X=0.26500000 Y=0.25000000 Z=0.00200000
          MULT= 4          ISPLIT= 8
      -2: X=0.73500000 Y=0.75000000 Z=0.99800000
      -2: X=0.76500000 Y=0.25000000 Z=0.49800000
      -2: X=0.23500000 Y=0.75000000 Z=0.50200000
Li         NPT=  781  R0=.000100000 RMT= 2.28        Z:   3.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.08618000 Y=0.25000000 Z=0.40190000
          MULT= 4          ISPLIT= 8
      -3: X=0.91382000 Y=0.75000000 Z=0.59810000
      -3: X=0.58618000 Y=0.25000000 Z=0.09810000
      -3: X=0.41382000 Y=0.75000000 Z=0.90190000
Zn         NPT=  781  R0=.000050000 RMT= 2.42        Z:  30.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -4: X=0.08861000 Y=0.25000000 Z=0.76978000
          MULT= 4          ISPLIT= 8
      -4: X=0.91139000 Y=0.75000000 Z=0.23022000
      -4: X=0.58861000 Y=0.25000000 Z=0.73022000
      -4: X=0.41139000 Y=0.75000000 Z=0.26978000
I          NPT=  781  R0=.000010000 RMT= 2.42        Z:  53.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -5: X=0.42430000 Y=0.25000000 Z=0.25128000
          MULT= 4          ISPLIT= 8
      -5: X=0.57570000 Y=0.75000000 Z=0.74872000
      -5: X=0.92430000 Y=0.25000000 Z=0.24872000
      -5: X=0.07570000 Y=0.75000000 Z=0.75128000
I          NPT=  781  R0=.000010000 RMT= 2.42        Z:  53.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -6: X=0.16639000 Y=0.00752000 Z=0.24808000
          MULT= 8          ISPLIT= 8
      -6: X=0.83361000 Y=0.99248000 Z=0.75192000
      -6: X=0.66639000 Y=0.00752000 Z=0.25192000
      -6: X=0.33361000 Y=0.99248000 Z=0.74808000
      -6: X=0.33361000 Y=0.50752000 Z=0.74808000
      -6: X=0.66639000 Y=0.49248000 Z=0.25192000
      -6: X=0.83361000 Y=0.50752000 Z=0.75192000
      -6: X=0.16639000 Y=0.49248000 Z=0.24808000
I          NPT=  781  R0=.000010000 RMT= 2.42        Z:  53.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000