CXZ LATTICE,NONEQUIV.ATOMS   8   15 B2/b                                       
MODE OF CALC=RELA unit=bohr                                                    
 26.720728 17.292884 15.278436 90.000000 90.000000 81.600000                   
ATOM  -1: X=0.68140000 Y=0.34220000 Z=0.08690000
          MULT= 4          ISPLIT= 8
      -1: X=0.31860000 Y=0.65780000 Z=0.91310000
      -1: X=0.31860000 Y=0.15780000 Z=0.08690000
      -1: X=0.68140000 Y=0.84220000 Z=0.91310000
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=0.89300000 Y=0.02310000 Z=0.07450000
          MULT= 4          ISPLIT= 8
      -2: X=0.10700000 Y=0.97690000 Z=0.92550000
      -2: X=0.10700000 Y=0.47690000 Z=0.07450000
      -2: X=0.89300000 Y=0.52310000 Z=0.92550000
Mo         NPT=  781  R0=.000010000 RMT= 1.70        Z:  42.00000              
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=0.25000000 Z=0.28860000
          MULT= 2          ISPLIT= 8
      -3: X=0.00000000 Y=0.75000000 Z=0.71140000
Mo         NPT=  781  R0=.000010000 RMT= 1.70        Z:  42.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.88000000 Y=0.18400000 Z=0.22700000
          MULT= 4          ISPLIT= 8
      -4: X=0.12000000 Y=0.81600000 Z=0.77300000
      -4: X=0.12000000 Y=0.31600000 Z=0.22700000
      -4: X=0.88000000 Y=0.68400000 Z=0.77300000
O          NPT=  781  R0=.000100000 RMT= 1.54        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  -5: X=0.97800000 Y=0.40900000 Z=0.08400000
          MULT= 4          ISPLIT= 8
      -5: X=0.02200000 Y=0.59100000 Z=0.91600000
      -5: X=0.02200000 Y=0.09100000 Z=0.08400000
      -5: X=0.97800000 Y=0.90900000 Z=0.91600000
O          NPT=  781  R0=.000100000 RMT= 1.54        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=0.64400000 Y=0.11900000 Z=0.31300000
          MULT= 4          ISPLIT= 8
      -6: X=0.35600000 Y=0.88100000 Z=0.68700000
      -6: X=0.35600000 Y=0.38100000 Z=0.31300000
      -6: X=0.64400000 Y=0.61900000 Z=0.68700000
O          NPT=  781  R0=.000100000 RMT= 1.54        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=0.79800000 Y=0.57800000 Z=0.05700000
          MULT= 4          ISPLIT= 8
      -7: X=0.20200000 Y=0.42200000 Z=0.94300000
      -7: X=0.20200000 Y=0.92200000 Z=0.05700000
      -7: X=0.79800000 Y=0.07800000 Z=0.94300000
O          NPT=  781  R0=.000100000 RMT= 1.54        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=0.94900000 Y=0.38500000 Z=0.42300000
          MULT= 4          ISPLIT= 8
      -8: X=0.05100000 Y=0.61500000 Z=0.57700000
      -8: X=0.05100000 Y=0.11500000 Z=0.42300000
      -8: X=0.94900000 Y=0.88500000 Z=0.57700000
O          NPT=  781  R0=.000100000 RMT= 1.54        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000