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STO-3G
AUTO1
 1 1  1.000000
 0     ANTI-7-CHLORO ENE - METHOXY GROUP CISOID TO BRIDGEHEAD STO-3G//STO-3G
 6          0.082565 -0.482267  0.352308
 6         -0.904082  0.513480 -0.259860
 6          0.716765  0.198394  1.598181
 1         -0.321941 -1.475199  0.530249
 6          1.221691 -0.372585 -0.695337
 6         -0.054838  1.620110 -0.901849
 6          1.386477  1.161394 -0.548998
 6          1.595505  1.328928  0.979648
 1          1.326166 -0.510799  2.151750
 1         -0.046448  0.585635  2.267417
 1          0.916754 -0.679823 -1.695925
17          2.714544 -1.332095 -0.300342
 6         -2.215186  0.443110 -0.237241
 1         -0.276210  2.607779 -0.501984
 1         -0.198567  1.657098 -1.981252
 1          1.290850  2.316903  1.313442
 1          2.641899  1.193683  1.238414
 1          2.161688  1.615355 -1.161317
 8         -2.882975 -0.592824  0.433615
 1         -2.837691  1.209376 -0.696417
 6         -4.185250 -0.819464 -0.127255
 1         -4.663749 -1.595021  0.473508
 1         -4.805660  0.081438 -0.093948
 1         -4.132414 -1.164811 -1.164624
99
 -0.002242  0.012084  0.010185 -0.034181 -0.098335  0.007487 -0.037605 -0.007586
 -0.319375 -0.604798 -0.029471  0.146494 -0.072545 -0.095538 -0.128672 -0.042178
  0.057131 -0.281435 -0.167035  0.181265 -0.148058  0.008160 -0.041110 -0.026098
 -0.037362 -0.086828  0.000098 -0.003174 -0.021925 -0.011400 -0.049314 -0.008298
  0.038624 -0.001347 -0.013686 -0.059674 -0.069388  0.015812 -0.004294  0.008272
 -0.023726  0.068406 -0.040048  0.013844  0.148486 -0.283144  0.166044 -0.057247
  0.002607 -0.015235  0.017764  0.387112  0.627151  0.193532 -0.184219  0.012898
 -0.003982 -0.005967  0.006995 -0.041808  0.080094 -0.094613 -0.172542  0.010093
 -0.013118  0.062959  0.078234 -0.029504 -0.005146 -0.028858  0.048814 -0.051735


Modified: Fri May 24 16:00:00 1991 GMT
Page accessed 5487 times since Sat Apr 17 22:02:04 1999 GMT