CXY LATTICE,NONEQUIV.ATOMS   5   64 Cmca                                       
MODE OF CALC=RELA unit=bohr                                                    
 22.017010 21.362976 10.962112 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.25000000 Y=0.21478000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -1: X=0.75000000 Y=0.78522000 Z=0.75000000
      -1: X=0.25000000 Y=0.71478000 Z=0.25000000
      -1: X=0.75000000 Y=0.28522000 Z=0.75000000
Li         NPT=  781  R0=.000100000 RMT= 2.18        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  -2: X=0.19046000 Y=0.00000000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -2: X=0.80954000 Y=0.00000000 Z=0.00000000
      -2: X=0.19046000 Y=0.50000000 Z=0.50000000
      -2: X=0.80954000 Y=0.50000000 Z=0.50000000
Li         NPT=  781  R0=.000100000 RMT= 2.18        Z:   3.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -3: X=0.00000000 Y=0.28316000 Z=0.39373000
          MULT= 4          ISPLIT= 8
      -3: X=0.00000000 Y=0.71684000 Z=0.60627000
      -3: X=0.00000000 Y=0.78316000 Z=0.10627000
      -3: X=0.00000000 Y=0.21684000 Z=0.89373000
Li         NPT=  781  R0=.000100000 RMT= 2.18        Z:   3.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -4: X=0.11975000 Y=0.38821000 Z=0.07862000
          MULT= 8          ISPLIT= 8
      -4: X=0.88025000 Y=0.61179000 Z=0.92138000
      -4: X=0.11975000 Y=0.88821000 Z=0.42138000
      -4: X=0.88025000 Y=0.11179000 Z=0.57862000
      -4: X=0.88025000 Y=0.38821000 Z=0.07862000
      -4: X=0.11975000 Y=0.61179000 Z=0.92138000
      -4: X=0.88025000 Y=0.88821000 Z=0.42138000
      -4: X=0.11975000 Y=0.11179000 Z=0.57862000
Al         NPT=  781  R0=.000100000 RMT= 2.49        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  -5: X=0.00000000 Y=0.05378000 Z=0.20440000
          MULT= 4          ISPLIT= 8
      -5: X=0.00000000 Y=0.94622000 Z=0.79560000
      -5: X=0.00000000 Y=0.55378000 Z=0.29560000
      -5: X=0.00000000 Y=0.44622000 Z=0.70440000
Al         NPT=  781  R0=.000100000 RMT= 2.49        Z:  13.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000