P   LATTICE,NONEQUIV.ATOMS   6   14 P21/n                                      
MODE OF CALC=RELA unit=bohr                                                    
 24.558881 13.235642 12.288889 90.000000 90.000000 93.300000                   
ATOM  -1: X=0.36460000 Y=0.15770000 Z=0.01500000
          MULT= 4          ISPLIT= 8
      -1: X=0.63540000 Y=0.84230000 Z=0.98500000
      -1: X=0.13540000 Y=0.34230000 Z=0.51500000
      -1: X=0.86460000 Y=0.65770000 Z=0.48500000
Li         NPT=  781  R0=.000100000 RMT= 1.16        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=0.10097000 Y=0.29410000 Z=0.32170000
          MULT= 4          ISPLIT= 8
      -2: X=0.89903000 Y=0.70590000 Z=0.67830000
      -2: X=0.39903000 Y=0.20590000 Z=0.82170000
      -2: X=0.60097000 Y=0.79410000 Z=0.17830000
Al         NPT=  781  R0=.000100000 RMT= 1.42        Z:  13.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.45333000 Y=0.30620000 Z=0.31680000
          MULT= 4          ISPLIT= 8
      -3: X=0.54667000 Y=0.69380000 Z=0.68320000
      -3: X=0.04667000 Y=0.19380000 Z=0.81680000
      -3: X=0.95333000 Y=0.80620000 Z=0.18320000
Cl         NPT=  781  R0=.000100000 RMT= 1.19        Z:  17.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.07141000 Y=0.19140000 Z=0.62810000
          MULT= 4          ISPLIT= 8
      -4: X=0.92859000 Y=0.80860000 Z=0.37190000
      -4: X=0.42859000 Y=0.30860000 Z=0.12810000
      -4: X=0.57141000 Y=0.69140000 Z=0.87190000
Cl         NPT=  781  R0=.000100000 RMT= 1.19        Z:  17.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.18614000 Y=0.07450000 Z=0.18120000
          MULT= 4          ISPLIT= 8
      -5: X=0.81386000 Y=0.92550000 Z=0.81880000
      -5: X=0.31386000 Y=0.42550000 Z=0.68120000
      -5: X=0.68614000 Y=0.57450000 Z=0.31880000
Cl         NPT=  781  R0=.000100000 RMT= 1.19        Z:  17.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.18705000 Y=0.56030000 Z=0.31400000
          MULT= 4          ISPLIT= 8
      -6: X=0.81295000 Y=0.43970000 Z=0.68600000
      -6: X=0.31295000 Y=0.93970000 Z=0.81400000
      -6: X=0.68705000 Y=0.06030000 Z=0.18600000
Cl         NPT=  781  R0=.000100000 RMT= 1.19        Z:  17.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000