B   LATTICE,NONEQUIV.ATOMS   4  140 I4/mcm                                     
MODE OF CALC=RELA unit=bohr                                                    
 14.601914 14.601914 28.020859 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.00000000 Z=0.25000000
          MULT= 2          ISPLIT=-2
      -1: X=0.00000000 Y=0.00000000 Z=0.75000000
Ge         NPT=  781  R0=.000050000 RMT= 2.43        Z:  32.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 2          ISPLIT=-2
      -2: X=0.00000000 Y=0.00000000 Z=0.50000000
Ca         NPT=  781  R0=.000050000 RMT= 2.50000     Z:  20.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.61830000 Y=0.11830000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -3: X=0.38170000 Y=0.88170000 Z=0.00000000
      -3: X=0.88170000 Y=0.61830000 Z=0.00000000
      -3: X=0.11830000 Y=0.38170000 Z=0.00000000
Ge         NPT=  781  R0=.000050000 RMT= 2.43        Z:  32.00000              
LOCAL ROT MATRIX:    0.0000000-0.7071068 0.7071068
                     0.0000000 0.7071068 0.7071068
                    -1.0000000 0.0000000 0.0000000
ATOM  -4: X=0.17820000 Y=0.67820000 Z=0.13990000
          MULT= 8          ISPLIT= 8
      -4: X=0.82180000 Y=0.32180000 Z=0.86010000
      -4: X=0.32180000 Y=0.17820000 Z=0.13990000
      -4: X=0.67820000 Y=0.82180000 Z=0.86010000
      -4: X=0.82180000 Y=0.32180000 Z=0.13990000
      -4: X=0.17820000 Y=0.67820000 Z=0.86010000
      -4: X=0.67820000 Y=0.82180000 Z=0.13990000
      -4: X=0.32180000 Y=0.17820000 Z=0.86010000
Ca         NPT=  781  R0=.000050000 RMT= 2.50000     Z:  20.00000              
LOCAL ROT MATRIX:    0.0000000-0.7071068-0.7071068
                     0.0000000-0.7071068 0.7071068
                    -1.0000000 0.0000000 0.0000000