MMs03927027 MOE2007 2D CORINA 3.40 0006 02.08.2006 83 86 0 0 1 0 0 0 0 0999 V2000 0.0000 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7470 1.3007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2470 1.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2529 -1.2939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 -1.2973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2529 -1.2871 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8529 -2.3263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7529 -1.2837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5059 -2.5810 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 0.0171 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 0.0205 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.2000 0.0205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7470 1.3212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9941 2.6185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4941 2.6151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7411 3.9125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4882 5.2132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9882 5.2166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7411 3.9193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7529 -1.2769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0059 -2.5776 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2529 -1.2735 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0059 -2.5708 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.6059 -1.5316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2588 -3.8715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0118 -5.1689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5118 -5.1654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2647 -6.4628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5177 -7.7635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0177 -7.7669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2647 -6.4696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5059 -2.5674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2588 -3.8647 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2529 -1.2666 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.7529 -1.2632 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 15.1529 -0.2240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5000 0.0375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0000 0.0409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7529 -1.2564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2529 -1.2530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9999 0.0477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2470 1.3451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7470 1.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5059 -2.5606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7588 -3.8613 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1447 2.3386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8447 2.3447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8553 -2.3318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1553 -2.3379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2889 1.1915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6267 0.4232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8976 1.0549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6680 0.5519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6645 2.0946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8964 1.5745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5411 3.9097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8858 6.2511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5858 6.2572 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9411 3.9220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8506 -0.2329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3378 -3.1023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3413 -4.6450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8106 -4.6451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4647 -6.4600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1200 -8.8014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4201 -8.8075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0647 -6.4723 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6506 -0.2288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3714 0.4454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7056 1.2198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4541 -1.7767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.8553 -2.2909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.1999 0.0505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.8446 2.3857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1446 2.3795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3059 -2.5906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0059 -2.5571 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5059 -2.5878 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1083 -3.6257 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