MMs03927373 MOE2007 2D CORINA 3.40 0006 02.08.2006 93 94 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 1.2445 -0.8374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5920 -0.1783 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7434 0.6702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6949 1.3182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8365 -1.0157 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6850 -1.8642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1202 -0.3341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1185 1.1659 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4406 -1.0313 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7094 -0.2240 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.7094 -1.4240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0374 -0.8699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2659 -0.0092 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1932 -2.3612 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5662 -2.9649 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.5270 -3.5649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7734 -4.4273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1725 -4.9681 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6158 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0 0 -1.8019 -8.3628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3020 -8.3520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4386 -7.0475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5425 -9.6672 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7425 -9.6759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3014 -7.3202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6149 -8.7870 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7616 -2.0587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1440 -2.6409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3394 -1.7347 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3311 -4.1291 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.8529 -4.4916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4370 -4.5948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6240 1.2735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8782 2.0963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7928 3.5939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0470 4.4166 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4532 4.2687 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3848 5.4667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4498 3.6105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6699 0.9956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9956 0.6699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6699 -0.9956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4119 -1.7015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9509 -1.8074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8921 1.2358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7773 2.5153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4977 1.4005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4890 -2.2303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2238 -3.0684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4895 -4.9730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8183 -8.5544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3536 -8.9737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3440 -9.7773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4958 -8.9840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4551 -6.5443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6571 -3.2129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6196 -3.2663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7108 -4.0473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4282 -4.7299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7613 -7.0779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3055 -9.3868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6386 -7.0388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8816 -1.2429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4122 -1.0504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4560 0.9982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1500 2.3760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3522 0.9939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0462 2.3716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5783 -8.5862 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5358 -7.9919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5849 -9.7862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4150 -6.3152 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 61 1 0 0 0 0 1 62 1 0 0 0 0 1 63 1 0 0 0 0 2 3 1 0 0 0 0 2 64 1 0 0 0 0 2 65 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 66 1 0 0 0 0 5 67 1 0 0 0 0 5 68 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 36 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 69 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 54 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 70 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 48 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 71 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 46 1 0 0 0 0 23 24 1 0 0 0 0 23 72 1 0 0 0 0 23 73 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 74 1 0 0 0 0 26 75 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 90 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 32 1 0 0 0 0 31 76 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 37 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 36 77 1 0 0 0 0 37 38 1 0 0 0 0 37 78 1 0 0 0 0 37 79 1 0 0 0 0 38 39 1 0 0 0 0 38 43 2 0 0 0 0 39 40 2 0 0 0 0 39 80 1 0 0 0 0 40 41 1 0 0 0 0 40 81 1 0 0 0 0 41 42 2 0 0 0 0 41 44 1 0 0 0 0 42 43 1 0 0 0 0 42 82 1 0 0 0 0 43 83 1 0 0 0 0 44 45 1 0 0 0 0 46 47 2 0 0 0 0 46 93 1 0 0 0 0 48 49 1 0 0 0 0 48 84 1 0 0 0 0 48 85 1 0 0 0 0 49 50 2 0 0 0 0 49 51 1 0 0 0 0 51 52 1 0 0 0 0 51 53 1 0 0 0 0 54 55 1 0 0 0 0 54 86 1 0 0 0 0 54 87 1 0 0 0 0 55 56 1 0 0 0 0 55 88 1 0 0 0 0 55 89 1 0 0 0 0 56 57 2 0 0 0 0 56 58 1 0 0 0 0 58 59 1 0 0 0 0 58 60 1 0 0 0 0 90 91 1 0 0 0 0 90 92 1 0 0 0 0 M CHG 1 93 -1 M END