CXZ LATTICE,NONEQUIV.ATOMS  10    5 B2                                         
MODE OF CALC=RELA unit=bohr                                                    
 25.583112 15.862361 10.344361 90.000000 90.000000 71.007000                   
ATOM  -1: X=0.00000000 Y=0.00000000 Z=0.05190000
          MULT= 1          ISPLIT= 8
Rb         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  37.00000              
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=0.21743000
          MULT= 1          ISPLIT= 8
Au         NPT=  781  R0=.000005000 RMT= 2.04        Z:  79.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.17766000 Y=0.16765000 Z=0.47780000
          MULT= 2          ISPLIT= 8
      -3: X=0.82234000 Y=0.83235000 Z=0.47780000
I          NPT=  781  R0=.000010000 RMT= 1.76        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=0.84658000 Y=0.34519000 Z=0.52720000
          MULT= 2          ISPLIT= 8
      -4: X=0.15342000 Y=0.65481000 Z=0.52720000
I          NPT=  781  R0=.000010000 RMT= 1.76        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  -5: X=0.89880000 Y=0.73500000 Z=0.18700000
          MULT= 2          ISPLIT= 8
      -5: X=0.10120000 Y=0.26500000 Z=0.18700000
O          NPT=  781  R0=.000100000 RMT= 1.51        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  -6: X=0.29560000 Y=0.19700000 Z=0.39000000
          MULT= 2          ISPLIT= 8
      -6: X=0.70440000 Y=0.80300000 Z=0.39000000
O          NPT=  781  R0=.000100000 RMT= 1.51        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  -7: X=0.80040000 Y=0.04300000 Z=0.35400000
          MULT= 2          ISPLIT= 8
      -7: X=0.19960000 Y=0.95700000 Z=0.35400000
O          NPT=  781  R0=.000100000 RMT= 1.51        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  -8: X=0.46830000 Y=0.20100000 Z=0.10000000
          MULT= 2          ISPLIT= 8
      -8: X=0.53170000 Y=0.79900000 Z=0.10000000
O          NPT=  781  R0=.000100000 RMT= 1.51        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  -9: X=0.64410000 Y=0.48100000 Z=0.19900000
          MULT= 2          ISPLIT= 8
      -9: X=0.35590000 Y=0.51900000 Z=0.19900000
O          NPT=  781  R0=.000100000 RMT= 1.51        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 -10: X=0.88060000 Y=0.41300000 Z=0.21800000
          MULT= 2          ISPLIT= 8
     -10: X=0.11940000 Y=0.58700000 Z=0.21800000
O          NPT=  781  R0=.000100000 RMT= 1.51        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000