MMs00679793 MOE2007 2D CORINA 3.40 0006 02.08.2006 36 37 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 1.5000 -0.0038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2467 -1.3047 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7467 -1.3085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -0.0151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7467 -1.3160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9935 -2.6131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4935 -2.6094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7402 -3.9065 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 8.2467 -1.3198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9934 -2.6207 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 -0.0226 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5000 -0.0264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2467 -1.3273 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.2532 1.2708 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7532 1.2670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5000 -0.0339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0000 -0.0377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7532 1.2595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0065 2.5604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5065 2.5642 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2946 1.1785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6287 0.4038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9026 1.0294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6026 1.0227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5908 -3.6539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4026 1.0181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6558 2.3115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8973 -1.0716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5973 -1.0784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9532 1.2565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6091 3.5981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 20 21 2 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 M END