P   LATTICE,NONEQUIV.ATOMS   4   14 P21/n                                      
MODE OF CALC=RELA unit=bohr                                                    
 17.707112  6.425069  9.743428 90.000000 90.000000105.818000                   
ATOM  -1: X=0.00738000 Y=0.40156000 Z=0.36582000
          MULT= 4          ISPLIT= 8
      -1: X=0.99262000 Y=0.59844000 Z=0.63418000
      -1: X=0.49262000 Y=0.09844000 Z=0.86582000
      -1: X=0.50738000 Y=0.90156000 Z=0.13418000
C          NPT=  781  R0=.000100000 RMT= 1.12        Z:   6.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.13379000 Y=0.50066000 Z=0.26302000
          MULT= 4          ISPLIT= 8
      -2: X=0.86621000 Y=0.49934000 Z=0.73698000
      -2: X=0.36621000 Y=0.99934000 Z=0.76302000
      -2: X=0.63379000 Y=0.00066000 Z=0.23698000
O          NPT=  781  R0=.000100000 RMT= 1.24        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.39351000 Y=0.15504000 Z=0.22028000
          MULT= 4          ISPLIT= 8
      -3: X=0.60649000 Y=0.84496000 Z=0.77972000
      -3: X=0.10649000 Y=0.34496000 Z=0.72028000
      -3: X=0.89351000 Y=0.65504000 Z=0.27972000
O          NPT=  781  R0=.000100000 RMT= 1.24        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.20821000 Y=0.15151000 Z=0.01344000
          MULT= 4          ISPLIT= 8
      -4: X=0.79179000 Y=0.84849000 Z=0.98656000
      -4: X=0.29179000 Y=0.34849000 Z=0.51344000
      -4: X=0.70821000 Y=0.65151000 Z=0.48656000
Li         NPT=  781  R0=.000100000 RMT= 1.68        Z:   3.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000