MMs00759694 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 45 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 0.7522 -1.2977 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2522 -1.2952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2522 -1.2900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5045 -2.5903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0045 -2.5929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2567 -3.8932 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4082 -3.0447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7652 -4.0526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4559 -5.5204 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7562 -6.2681 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8692 -5.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3369 -5.5718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9494 -6.9411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4409 -6.7817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7503 -5.3140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4499 -4.5662 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9134 -6.1328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1284 -5.2532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4977 -5.8657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6519 -7.3577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4369 -8.2373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0676 -7.6249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0212 -7.9702 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0382 0.6018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6018 1.0382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0382 -0.6018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3982 1.0434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0982 1.0480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4522 -1.2879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1063 -3.6285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7631 -2.8526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4284 -3.9292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3512 -7.9814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2454 -7.6721 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8457 -4.8240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0051 -4.0596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4697 -5.1620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5603 -9.4310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0956 -8.3285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 20 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 19 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 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 M END