RDKit 3D 57 60 0 0 0 0 0 0 0 0999 V2000 -6.4713 3.6172 1.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3551 2.7473 0.7463 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1056 1.5041 1.3362 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0926 0.6750 0.8455 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3196 1.0788 -0.2516 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5726 2.3184 -0.8497 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5880 3.1424 -0.3541 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3053 0.2206 -0.7652 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3611 -1.1696 -0.9078 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1928 -1.6051 -1.3446 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3750 -0.5338 -1.5541 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0333 0.5477 -1.2159 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2938 2.1168 -1.1309 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1175 1.9027 -2.2569 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2495 1.0455 -1.7172 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0607 0.5023 -2.4726 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3773 0.9905 -0.3387 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3046 0.0514 0.1541 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3096 0.4395 1.0201 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2602 1.4604 1.8894 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5499 -0.3569 0.9611 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8158 -1.3336 1.9322 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9813 -2.1013 1.8694 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8940 -1.8988 0.8346 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6329 -0.9183 -0.1332 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4650 -0.1477 -0.0793 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6021 -0.6894 -1.2095 N 0 0 0 0 0 4 0 0 0 0 0 0 9.4570 -1.5634 -1.4079 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5155 0.3675 -1.8493 O 0 0 0 0 0 1 0 0 0 0 0 0 -3.5193 -2.0431 -0.7049 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3721 -3.2117 0.0571 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4566 -4.0697 0.2594 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6915 -3.7699 -0.3122 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8492 -2.6251 -1.0906 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7639 -1.7670 -1.2923 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0289 -4.8219 -0.0610 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -6.2158 4.6773 1.1348 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6689 3.4353 2.3042 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3836 3.4135 0.6741 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6997 1.1719 2.1875 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9128 -0.2661 1.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0320 2.6522 -1.7319 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7847 4.0946 -0.8427 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7652 1.4704 -3.1999 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5318 2.8934 -2.4713 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5370 1.0865 0.2235 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6501 -0.5536 -0.6057 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1016 1.7115 2.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3753 2.0796 1.9749 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1069 -1.5027 2.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1747 -2.8580 2.6273 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7987 -2.5017 0.7968 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2558 0.6094 -0.8356 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4058 -3.4614 0.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3271 -4.9681 0.8561 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8089 -2.3968 -1.5483 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9029 -0.8889 -1.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 2 0 5 8 1 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 2 0 15 17 1 0 17 18 1 0 18 19 1 0 19 20 2 0 19 21 1 0 21 22 2 0 22 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 25 27 1 0 27 28 2 0 27 29 1 0 9 30 1 0 30 31 2 0 31 32 1 0 32 33 2 0 33 34 1 0 34 35 2 0 33 36 1 0 7 2 1 0 12 8 1 0 26 21 1 0 35 30 1 0 1 37 1 0 1 38 1 0 1 39 1 0 3 40 1 0 4 41 1 0 6 42 1 0 7 43 1 0 14 44 1 0 14 45 1 0 17 46 1 0 18 47 1 0 20 48 1 0 20 49 1 0 22 50 1 0 23 51 1 0 24 52 1 0 26 53 1 0 31 54 1 0 32 55 1 0 34 56 1 0 35 57 1 0 M CHG 2 27 1 29 -1 M END