CXZ LATTICE,NONEQUIV.ATOMS   9    5 B2                                         
MODE OF CALC=RELA unit=bohr                                                    
 18.131544 18.261935 15.799622 90.000000 90.000000 85.363000                   
ATOM  -1: X=0.00000000 Y=0.50000000 Z=0.63938000
          MULT= 1          ISPLIT= 8
Hg         NPT=  781  R0=.000005000 RMT= 2.48        Z:  80.00000              
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=0.50000000 Z=0.15704000
          MULT= 1          ISPLIT= 8
Hg         NPT=  781  R0=.000005000 RMT= 2.48        Z:  80.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.00000000 Y=0.00000000 Z=0.47977000
          MULT= 1          ISPLIT= 8
Hg         NPT=  781  R0=.000005000 RMT= 2.48        Z:  80.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.76577000 Y=0.27003000 Z=0.33731000
          MULT= 2          ISPLIT= 8
      -4: X=0.23423000 Y=0.72997000 Z=0.33731000
Ge         NPT=  781  R0=.000050000 RMT= 2.19        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  -5: X=0.74830000 Y=0.45980000 Z=0.47770000
          MULT= 2          ISPLIT= 8
      -5: X=0.25170000 Y=0.54020000 Z=0.47770000
S          NPT=  781  R0=.000100000 RMT= 1.89        Z:  16.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.76230000 Y=0.07770000 Z=0.48570000
          MULT= 2          ISPLIT= 8
      -6: X=0.23770000 Y=0.92230000 Z=0.48570000
S          NPT=  781  R0=.000100000 RMT= 1.89        Z:  16.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -7: X=0.57850000 Y=0.25910000 Z=0.18210000
          MULT= 2          ISPLIT= 8
      -7: X=0.42150000 Y=0.74090000 Z=0.18210000
S          NPT=  781  R0=.000100000 RMT= 1.89        Z:  16.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -8: X=0.96340000 Y=0.25550000 Z=0.19880000
          MULT= 2          ISPLIT= 8
      -8: X=0.03660000 Y=0.74450000 Z=0.19880000
S          NPT=  781  R0=.000100000 RMT= 1.89        Z:  16.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -9: X=0.28430000 Y=0.22860000 Z=0.34830000
          MULT= 2          ISPLIT= 8
      -9: X=0.71570000 Y=0.77140000 Z=0.34830000
K          NPT=  781  R0=.000050000 RMT= 2.50000     Z:  19.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000