CXZ LATTICE,NONEQUIV.ATOMS   7    5 B2                                         
MODE OF CALC=RELA unit=bohr                                                    
 13.224115 12.303251 15.518809 90.000000 90.000000 65.070000                   
ATOM  -1: X=0.79577000 Y=0.21347000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -1: X=0.20423000 Y=0.78653000 Z=0.00000000
Si         NPT=  781  R0=.000100000 RMT= 1.41        Z:  14.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.39511000 Y=0.35902000 Z=0.18017000
          MULT= 2          ISPLIT= 8
      -2: X=0.60489000 Y=0.64098000 Z=0.18017000
Si         NPT=  781  R0=.000100000 RMT= 1.41        Z:  14.00000              
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=0.50000000 Z=0.78246000
          MULT= 1          ISPLIT= 8
O          NPT=  781  R0=.000100000 RMT= 1.64        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  -4: X=0.00000000 Y=0.00000000 Z=0.06947000
          MULT= 1          ISPLIT= 8
O          NPT=  781  R0=.000100000 RMT= 1.64        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=0.79134000 Y=0.44947000 Z=0.07324000
          MULT= 2          ISPLIT= 8
      -5: X=0.20866000 Y=0.55053000 Z=0.07324000
O          NPT=  781  R0=.000100000 RMT= 1.64        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=0.58050000 Y=0.19267000 Z=0.05842000
          MULT= 2          ISPLIT= 8
      -6: X=0.41950000 Y=0.80733000 Z=0.05842000
O          NPT=  781  R0=.000100000 RMT= 1.64        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=0.30752000 Y=0.22134000 Z=0.30233000
          MULT= 2          ISPLIT= 8
      -7: X=0.69248000 Y=0.77866000 Z=0.30233000
O          NPT=  781  R0=.000100000 RMT= 1.64        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000