MMs01543613 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 43 0 0 0 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 1.2940 -0.7586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2841 -2.2586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5781 -3.0172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8821 -2.2758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8921 -0.7758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6080 1.4827 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4003 2.3724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8733 3.7959 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3732 3.7860 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8273 2.3564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2508 1.8834 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.3721 2.8797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7956 2.4067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0977 0.9374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5212 0.4645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8234 -1.0048 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6426 1.4608 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.1333 1.2941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7525 2.6603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6444 3.6714 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.3404 2.9300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9170 3.4030 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.8747 -0.0099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6069 1.0352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0352 0.6069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6069 -1.0352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2409 -2.8517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5702 -4.2171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9173 -2.8827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9352 -0.1827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2566 2.0092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4314 3.6247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9425 3.9354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2007 0.1404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9279 2.9020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8315 -0.6030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4678 -1.0531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9178 0.5832 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 2 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 23 1 0 0 0 0 20 21 2 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 M END