P   LATTICE,NONEQUIV.ATOMS   5  218 P-43n                                      
MODE OF CALC=RELA unit=bohr                                                    
 16.536049 16.536049 16.536049 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.25000000 Y=0.50000000 Z=0.00000000
          MULT= 6          ISPLIT=-2
      -1: X=0.00000000 Y=0.25000000 Z=0.50000000
      -1: X=0.75000000 Y=0.50000000 Z=0.00000000
      -1: X=0.00000000 Y=0.75000000 Z=0.50000000
      -1: X=0.50000000 Y=0.00000000 Z=0.25000000
      -1: X=0.50000000 Y=0.00000000 Z=0.75000000
Al         NPT=  781  R0=.000100000 RMT= 1.63        Z:  13.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -2: X=0.25000000 Y=0.00000000 Z=0.50000000
          MULT= 6          ISPLIT=-2
      -2: X=0.50000000 Y=0.25000000 Z=0.00000000
      -2: X=0.75000000 Y=0.00000000 Z=0.50000000
      -2: X=0.50000000 Y=0.75000000 Z=0.00000000
      -2: X=0.00000000 Y=0.50000000 Z=0.25000000
      -2: X=0.00000000 Y=0.50000000 Z=0.75000000
Ge         NPT=  781  R0=.000050000 RMT= 1.73        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=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 2          ISPLIT= 2
       3: X=0.50000000 Y=0.50000000 Z=0.50000000
I          NPT=  781  R0=.000010000 RMT= 2.50000     Z:  53.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.13990000 Y=0.14160000 Z=0.40940000
          MULT=24          ISPLIT= 8
      -4: X=0.64160000 Y=0.36010000 Z=0.09060000
      -4: X=0.13990000 Y=0.85840000 Z=0.59060000
      -4: X=0.40940000 Y=0.13990000 Z=0.14160000
      -4: X=0.86010000 Y=0.85840000 Z=0.40940000
      -4: X=0.35840000 Y=0.36010000 Z=0.90940000
      -4: X=0.63990000 Y=0.09060000 Z=0.35840000
      -4: X=0.35840000 Y=0.63990000 Z=0.09060000
      -4: X=0.86010000 Y=0.14160000 Z=0.59060000
      -4: X=0.59060000 Y=0.86010000 Z=0.14160000
      -4: X=0.64160000 Y=0.63990000 Z=0.90940000
      -4: X=0.36010000 Y=0.90940000 Z=0.35840000
      -4: X=0.40940000 Y=0.86010000 Z=0.85840000
      -4: X=0.36010000 Y=0.09060000 Z=0.64160000
      -4: X=0.59060000 Y=0.13990000 Z=0.85840000
      -4: X=0.63990000 Y=0.90940000 Z=0.64160000
      -4: X=0.09060000 Y=0.64160000 Z=0.36010000
      -4: X=0.14160000 Y=0.40940000 Z=0.13990000
      -4: X=0.90940000 Y=0.35840000 Z=0.36010000
      -4: X=0.85840000 Y=0.59060000 Z=0.13990000
      -4: X=0.09060000 Y=0.35840000 Z=0.63990000
      -4: X=0.85840000 Y=0.40940000 Z=0.86010000
      -4: X=0.90940000 Y=0.64160000 Z=0.63990000
      -4: X=0.14160000 Y=0.59060000 Z=0.86010000
O          NPT=  781  R0=.000100000 RMT= 1.57        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  -5: X=0.19280000 Y=0.19280000 Z=0.19280000
          MULT= 8          ISPLIT= 4
      -5: X=0.69280000 Y=0.30720000 Z=0.30720000
      -5: X=0.19280000 Y=0.80720000 Z=0.80720000
      -5: X=0.80720000 Y=0.80720000 Z=0.19280000
      -5: X=0.30720000 Y=0.30720000 Z=0.69280000
      -5: X=0.30720000 Y=0.69280000 Z=0.30720000
      -5: X=0.80720000 Y=0.19280000 Z=0.80720000
      -5: X=0.69280000 Y=0.69280000 Z=0.69280000
Li         NPT=  781  R0=.000100000 RMT= 1.69        Z:   3.00000              
LOCAL ROT MATRIX:    0.7071068 0.4082483 0.5773503
                    -0.7071068 0.4082483 0.5773503
                     0.0000000-0.8164966 0.5773503