MMs00938567 MOE2007 2D CORINA 3.40 0006 02.08.2006 63 66 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 1.2977 -0.7523 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8958 -0.7568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4939 -0.7613 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7968 1.4864 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0919 -0.7659 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.0527 -1.3659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0893 -2.2659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3871 -3.0181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6874 -2.2704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 -0.0181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9904 -0.0227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2881 -0.7749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4423 -2.2670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9090 -2.5814 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.6612 -1.2837 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.6595 -0.1672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9739 1.2995 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.9721 2.4159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7244 3.7136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1911 3.3992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3453 1.9072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1533 -1.1295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7658 0.2397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2578 0.3939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1374 -0.8211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.5249 -2.1904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0328 -2.3446 0.0000 C 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 -0.6018 -1.0382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8283 0.9161 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3710 0.9134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1229 -1.6747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6655 -1.6774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4264 0.9115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9691 0.9088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4918 -1.9613 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9079 -2.0554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6769 -3.3928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6141 -3.9360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1568 -3.9387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0959 -3.3987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8695 -2.0641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6225 0.9025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1652 0.8998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7633 0.8952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2206 0.8979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5491 -3.0684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7785 2.2926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2382 4.8107 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0843 4.2006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8644 1.6063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4139 0.7258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.7478 1.4893 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.3310 -0.6978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.2285 -3.1624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.5428 -3.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6900 -0.7704 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 11.6900 0.4296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 7 8 2 0 0 0 0 7 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 42 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 46 1 0 0 0 0 13 47 1 0 0 0 0 13 62 1 0 0 0 0 14 48 1 0 0 0 0 14 49 1 0 0 0 0 14 62 1 0 0 0 0 15 16 1 0 0 0 0 15 50 1 0 0 0 0 15 51 1 0 0 0 0 15 62 1 0 0 0 0 16 17 1 0 0 0 0 16 20 2 0 0 0 0 17 18 2 0 0 0 0 17 52 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 26 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 22 23 2 0 0 0 0 22 53 1 0 0 0 0 23 24 1 0 0 0 0 23 54 1 0 0 0 0 24 25 2 0 0 0 0 24 55 1 0 0 0 0 25 56 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 57 1 0 0 0 0 28 29 1 0 0 0 0 28 58 1 0 0 0 0 29 30 2 0 0 0 0 29 59 1 0 0 0 0 30 31 1 0 0 0 0 30 60 1 0 0 0 0 31 61 1 0 0 0 0 62 63 1 0 0 0 0 M CHG 1 62 1 M END