B   LATTICE,NONEQUIV.ATOMS   3   88 I41/a                                      
MODE OF CALC=RELA unit=bohr                                                    
  9.195407  9.195407 19.936611 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.25000000 Z=0.62500000
          MULT= 2          ISPLIT=-2
      -1: X=0.00000000 Y=0.75000000 Z=0.37500000
Zr         NPT=  781  R0=.000010000 RMT= 2.11        Z:  40.00000              
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=0.25000000 Z=0.12500000
          MULT= 2          ISPLIT=-2
      -2: X=0.00000000 Y=0.75000000 Z=0.87500000
Ge         NPT=  781  R0=.000050000 RMT= 1.75        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  -3: X=0.26640000 Y=0.07740000 Z=0.04280000
          MULT= 8          ISPLIT= 8
      -3: X=0.73360000 Y=0.92260000 Z=0.95720000
      -3: X=0.17260000 Y=0.01640000 Z=0.79280000
      -3: X=0.32740000 Y=0.48360000 Z=0.70720000
      -3: X=0.73360000 Y=0.42260000 Z=0.04280000
      -3: X=0.26640000 Y=0.57740000 Z=0.95720000
      -3: X=0.32740000 Y=0.98360000 Z=0.29280000
      -3: X=0.17260000 Y=0.51640000 Z=0.20720000
O          NPT=  781  R0=.000100000 RMT= 1.58        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000