CB8108157.mol ChemDraw02030800182D 108113 0 0 1 0 0 0 0 0999 V2000 0.0838 -3.3630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0342 -4.1324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7849 -2.9410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6422 -3.0217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7352 -4.3618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6422 -4.7280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7849 -2.1096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1757 -3.6484 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9463 -5.1623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4065 -5.5283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4985 -1.7063 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0342 -1.7063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3692 -5.7394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2182 -2.1096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6794 -2.1096 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0342 -0.8687 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9256 -1.7063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2182 -2.9410 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3992 -1.7063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6453 -2.1096 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9256 -0.8687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1250 -2.1220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3992 -0.8687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3587 -1.7063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6453 -0.4653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2182 -0.4653 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8262 -1.7063 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1065 -2.9410 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6794 -0.4653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1065 -0.4653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0848 -2.1096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3587 -0.8687 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5336 -2.1096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7858 -1.7063 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0848 -2.9410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2594 -1.7063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5336 -2.9410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7858 -0.8687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3587 -3.3257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9668 -2.1096 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2594 -0.8687 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2594 -3.3257 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.5119 -0.4653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0848 -0.4653 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3587 -4.1509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6453 -2.9410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6865 -1.7063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5119 0.3538 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3185 -0.7259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6865 -0.8687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3938 -2.1096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3185 0.5956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7858 0.7818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7651 -0.0621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3938 -0.4653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1199 -1.7063 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3938 -2.9410 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7858 1.5885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0848 0.3538 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3938 0.3538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0848 2.0289 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.1199 0.7818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0848 2.8108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1199 1.5885 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3587 3.2450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7858 3.2450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3587 4.0640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6453 2.8108 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0661 4.4984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9256 3.2450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0661 5.3360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7673 4.0827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2182 2.8108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9256 4.0640 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7673 5.7394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4931 4.4984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2182 2.0289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4985 3.2450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4931 5.3360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9069 1.6070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7849 2.8108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9752 0.8004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6453 1.9235 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0342 3.2637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7849 2.0289 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7941 0.5956 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2099 1.3153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6794 2.8108 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0342 4.0516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3992 3.2450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7539 4.4363 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.1065 2.8108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3992 4.0640 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8262 3.2450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1065 2.0289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5336 2.8108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3992 1.5885 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2594 3.2450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5336 2.0289 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9482 2.8480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2594 4.0516 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6617 3.2450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6617 4.0516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3443 2.8480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3443 4.4674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0578 3.2450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0578 4.0516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7651 4.4363 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 1 3 1 0 1 4 2 0 2 5 2 0 2 6 1 0 3 7 1 0 4 8 1 0 5 9 1 0 6 10 2 0 7 11 1 1 7 12 1 0 9 13 2 0 11 14 1 0 12 15 1 0 12 16 2 0 14 17 1 0 14 18 2 0 19 15 1 6 17 20 1 6 17 21 1 0 19 22 1 0 19 23 1 0 20 24 1 0 21 25 1 0 21 26 1 6 22 27 1 0 22 28 2 0 23 29 1 0 23 30 1 0 24 31 1 0 24 32 2 0 33 27 1 1 31 34 1 1 31 35 1 0 33 36 1 0 33 37 1 0 34 38 1 0 35 39 1 0 36 40 1 0 36 41 2 0 37 42 1 0 43 38 1 1 38 44 2 0 39 45 1 0 39 46 1 0 47 40 1 6 43 48 1 0 43 49 1 0 47 50 1 0 47 51 1 0 48 52 1 0 48 53 1 0 49 54 1 0 50 55 1 0 51 56 1 0 51 57 2 0 53 58 1 0 53 59 2 0 55 60 1 0 58 61 1 0 60 62 1 0 61 63 1 0 62 64 1 0 63 65 1 0 63 66 2 0 65 67 1 0 65 68 1 1 67 69 1 0 68 70 1 0 69 71 2 0 69 72 1 0 70 73 1 0 70 74 2 0 71 75 1 0 72 76 2 0 73 77 1 0 73 78 1 6 75 79 2 0 77 80 1 0 78 81 1 0 80 82 2 0 80 83 1 0 81 84 1 0 81 85 2 0 82 86 1 0 83 87 2 0 84 88 1 1 84 89 1 0 88 90 1 0 89 91 1 0 90 92 1 0 90 93 2 0 92 94 1 6 92 95 1 0 94 96 1 0 95 97 1 0 96 98 1 0 96 99 2 0 98100 1 0 98101 1 6 100102 1 0 102103 2 0 102104 1 0 103105 1 0 104106 2 0 105107 2 0 107108 1 0 5 8 1 0 10 13 1 0 52 54 1 0 76 79 1 0 86 87 1 0 106107 1 0 V 1 0 V 2 1 V 3 2 V 4 3 V 5 4 V 6 5 V 7 6 V 8 7 V 9 8 V 10 9 V 11 10 V 12 11 V 13 12 V 14 13 V 15 14 V 16 15 V 17 16 V 18 17 V 19 18 V 20 19 V 21 20 V 22 21 V 23 22 V 24 23 V 25 24 V 26 25 V 27 26 V 28 27 V 29 28 V 30 29 V 31 30 V 32 31 V 33 32 V 34 33 V 35 34 V 36 35 V 37 36 V 38 37 V 39 38 V 40 39 V 41 40 V 42 41 V 43 42 V 44 43 V 45 44 V 46 45 V 47 46 V 48 47 V 49 48 V 50 49 V 51 50 V 52 51 V 53 52 V 54 53 V 55 54 V 56 55 V 57 56 V 58 57 V 59 58 V 60 59 V 61 60 V 62 61 V 63 62 V 64 63 V 65 64 V 66 65 V 67 66 V 68 67 V 69 68 V 70 69 V 71 70 V 72 71 V 73 72 V 74 73 V 75 74 V 76 75 V 77 76 V 78 77 V 79 78 V 80 79 V 81 80 V 82 81 V 83 82 V 84 83 V 85 84 V 86 85 V 87 86 V 88 87 V 89 88 V 90 89 V 91 90 V 92 91 V 93 92 V 94 93 V 95 94 V 96 95 V 97 96 V 98 97 V 99 98 V 100 99 V 101 100 V 102 101 V 103 102 V 104 103 V 105 104 V 106 105 V 107 106 V 108 107 M END