B   LATTICE,NONEQUIV.ATOMS   4  141 I41/amd                                    
MODE OF CALC=RELA unit=bohr                                                    
 12.470681 12.470681 19.555453 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.25000000 Z=0.25460000
          MULT= 4          ISPLIT= 8
      -1: X=0.00000000 Y=0.75000000 Z=0.74540000
      -1: X=0.00000000 Y=0.75000000 Z=0.50460000
      -1: X=0.50000000 Y=0.75000000 Z=0.99540000
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
ATOM  -2: X=0.22930000 Y=0.47930000 Z=0.87500000
          MULT= 8          ISPLIT= 8
      -2: X=0.77070000 Y=0.52070000 Z=0.12500000
      -2: X=0.77070000 Y=0.97930000 Z=0.12500000
      -2: X=0.72930000 Y=0.52070000 Z=0.37500000
      -2: X=0.77070000 Y=0.47930000 Z=0.87500000
      -2: X=0.22930000 Y=0.52070000 Z=0.12500000
      -2: X=0.77070000 Y=0.02070000 Z=0.87500000
      -2: X=0.22930000 Y=0.97930000 Z=0.12500000
Li         NPT=  781  R0=.000100000 RMT= 1.68        Z:   3.00000              
LOCAL ROT MATRIX:    0.0000000 0.7071068 0.7071068
                     0.0000000-0.7071068 0.7071068
                     1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.00000000 Y=0.25000000 Z=0.02200000
          MULT= 4          ISPLIT= 8
      -3: X=0.00000000 Y=0.75000000 Z=0.97800000
      -3: X=0.00000000 Y=0.75000000 Z=0.27200000
      -3: X=0.50000000 Y=0.75000000 Z=0.22800000
B          NPT=  781  R0=.000100000 RMT= 1.23        Z:   5.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.00000000 Y=0.54100000 Z=0.28040000
          MULT= 8          ISPLIT= 8
      -4: X=0.00000000 Y=0.45900000 Z=0.71960000
      -4: X=0.70900000 Y=0.75000000 Z=0.53040000
      -4: X=0.79100000 Y=0.75000000 Z=0.96960000
      -4: X=0.00000000 Y=0.95900000 Z=0.28040000
      -4: X=0.00000000 Y=0.04100000 Z=0.71960000
      -4: X=0.79100000 Y=0.25000000 Z=0.03040000
      -4: X=0.70900000 Y=0.25000000 Z=0.46960000
N          NPT=  781  R0=.000100000 RMT= 1.36        Z:   7.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000