RDKit 3D 120123 0 0 0 0 0 0 0 0999 V2000 7.8108 4.1303 -3.4005 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2211 3.2623 -2.4743 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7954 2.1244 -1.9742 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9400 1.8013 -2.3561 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0786 1.2666 -0.9836 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6758 1.8146 -0.7248 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9934 0.9783 0.2422 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9867 0.1027 -0.1819 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6748 0.0079 -1.3695 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2804 -0.7254 0.8261 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3288 -1.6522 0.2986 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0696 -1.2645 -0.2499 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7458 -0.0479 -0.2885 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0878 -2.2474 -0.7914 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.1522 -1.6988 -1.1736 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0352 -0.7880 -0.4639 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7434 0.4435 -0.3751 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3327 1.5626 0.2002 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7559 1.6583 1.5877 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8560 1.5443 2.4687 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0583 1.8664 2.0928 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4721 1.9529 3.4805 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5258 3.0354 3.4933 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7729 3.3260 2.0361 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.9766 4.5119 1.5497 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2811 2.0327 1.4148 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.4489 1.9908 -0.0048 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5694 3.1591 -0.5104 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5046 0.9469 -0.9280 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3510 -0.2215 -1.0439 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.9944 -0.0822 -2.4418 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.9535 -0.0641 -3.5302 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8729 1.1345 -2.5245 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6217 -1.5062 -0.9543 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3819 -2.5423 -0.9436 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2434 -1.7228 -0.8837 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3040 -1.2066 0.1401 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.1713 -2.2676 1.2348 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.5851 -3.5484 0.8239 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4738 -1.6212 2.4108 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5999 -2.5597 1.7286 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7404 -2.6845 -2.1413 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9143 -1.4778 -3.0215 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2723 -3.5887 -2.8534 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9876 -3.4596 -1.9866 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0723 -1.1240 2.0011 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3039 -2.0067 2.9737 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3901 -1.7260 1.7659 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5064 -1.3698 2.5368 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7432 -1.9209 2.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9268 -2.8502 1.3211 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8496 -3.2186 0.5501 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6138 -2.6510 0.7886 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7623 3.2322 -0.2031 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1754 3.5963 1.0136 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1949 4.8410 1.3389 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7820 5.7566 0.4002 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3841 4.7314 -0.9168 S 0 0 0 0 0 0 0 0 0 0 0 0 7.0158 4.8028 -3.8353 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2698 3.5693 -4.2476 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5674 4.7812 -2.9425 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6383 1.3047 -0.0313 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0144 0.2467 -1.3849 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1982 1.8625 -1.7076 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2640 1.0412 1.2446 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5577 0.1117 1.2582 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5303 -2.6665 0.3426 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0838 -3.1118 -0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5386 -1.9819 -2.1376 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4774 2.3536 0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0491 2.1077 -0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9179 1.0014 3.8396 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6820 2.3199 4.1595 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2464 3.9458 4.0264 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5023 2.6845 3.9096 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8420 3.4323 1.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6072 5.0679 0.8282 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7049 5.1887 2.3848 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0871 4.1340 1.0096 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9788 1.2379 1.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7964 0.9731 -1.7206 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2322 -0.1698 -0.3615 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6028 -1.0091 -2.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8768 0.9349 -3.9719 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2364 -0.7536 -4.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9526 -0.4404 -3.1686 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6232 0.9712 -3.3265 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4133 1.3918 -1.6149 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2158 1.9763 -2.8853 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7617 -2.3102 -1.5979 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8224 -0.4137 0.6348 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6285 -3.7059 1.3757 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2131 -4.4346 1.1599 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3999 -3.7035 -0.2325 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5432 -1.1282 2.1392 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2035 -2.3716 3.1913 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1642 -0.8739 2.8462 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1984 -1.6486 1.5455 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5800 -2.7164 2.8321 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9969 -3.4689 1.2316 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5460 -1.6560 -4.0379 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0225 -1.3206 -3.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5203 -0.5522 -2.5503 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7898 -3.0540 -3.6439 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2294 -4.5224 -3.2079 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9996 -3.9277 -2.1018 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8777 -2.8131 -1.9156 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8836 -4.2358 -1.2205 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0867 -4.0659 -2.9529 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2894 -0.1978 2.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0381 -2.2426 3.7971 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4284 -1.5170 3.3942 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0985 -2.9625 2.4554 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3924 -0.6431 3.3239 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6139 -1.6352 2.9241 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9273 -3.2863 1.1519 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0053 -3.9580 -0.2377 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7933 -2.9675 0.1491 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5281 5.2025 2.3349 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7383 6.8562 0.5154 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 3 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 8 10 1 0 10 11 1 0 11 12 1 0 12 13 2 0 12 14 1 0 14 15 1 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 1 0 19 20 2 0 19 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 24 26 1 0 26 27 1 0 27 28 2 0 27 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 31 33 1 0 30 34 1 0 34 35 2 0 34 36 1 0 36 37 1 0 37 38 1 0 38 39 1 6 38 40 1 0 38 41 1 0 14 42 1 0 42 43 1 6 42 44 1 0 42 45 1 0 10 46 1 0 46 47 1 0 46 48 1 0 48 49 2 0 49 50 1 0 50 51 2 0 51 52 1 0 52 53 2 0 6 54 1 0 54 55 2 0 55 56 1 0 56 57 2 0 57 58 1 0 37 16 1 0 53 48 1 0 58 54 1 0 26 21 1 0 1 59 1 0 1 60 1 0 1 61 1 0 5 62 1 0 5 63 1 0 6 64 1 6 7 65 1 0 10 66 1 1 11 67 1 0 14 68 1 1 15 69 1 0 18 70 1 0 18 71 1 0 22 72 1 0 22 73 1 0 23 74 1 0 23 75 1 0 24 76 1 1 25 77 1 0 25 78 1 0 25 79 1 0 26 80 1 1 29 81 1 0 30 82 1 1 31 83 1 6 32 84 1 0 32 85 1 0 32 86 1 0 33 87 1 0 33 88 1 0 33 89 1 0 36 90 1 0 37 91 1 1 39 92 1 0 39 93 1 0 39 94 1 0 40 95 1 0 40 96 1 0 40 97 1 0 41 98 1 0 41 99 1 0 41100 1 0 43101 1 0 43102 1 0 43103 1 0 44104 1 0 44105 1 0 44106 1 0 45107 1 0 45108 1 0 45109 1 0 46110 1 1 47111 1 0 47112 1 0 47113 1 0 49114 1 0 50115 1 0 51116 1 0 52117 1 0 53118 1 0 56119 1 0 57120 1 0 M END