RDKit 3D 51 54 0 0 0 0 0 0 0 0999 V2000 1.8562 -2.7577 -4.4571 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8582 -1.7471 -3.3487 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2792 -0.4876 -3.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2529 0.4377 -2.4806 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7972 0.1181 -1.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3680 -1.1515 -1.0519 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3929 -2.0752 -2.0994 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7689 1.1002 -0.0522 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3063 1.4360 0.3605 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1440 2.7815 1.6137 S 0 0 0 0 0 0 0 0 0 0 0 0 1.7080 3.5057 1.5918 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1585 4.4203 2.4168 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4631 4.6956 2.0573 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7708 3.9397 1.0199 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6782 3.1813 0.6851 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5655 2.2907 -0.4269 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0608 3.8901 0.3014 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3972 0.2019 0.9532 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2371 -0.7374 1.4241 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7826 0.3133 0.9131 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7441 -0.6540 1.2916 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3949 -1.9744 1.6048 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3633 -2.9193 1.9778 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7052 -2.5420 2.0088 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0715 -1.2347 1.6924 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1052 -0.2801 1.3303 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5719 1.1133 1.0051 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9593 -4.3306 2.2854 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7903 -3.3291 -4.4609 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0168 -3.4487 -4.3312 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7665 -2.2732 -5.4356 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8438 -0.2180 -4.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7988 1.4080 -2.6663 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7855 -1.4414 -0.0886 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8288 -3.0574 -1.9294 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2810 0.6207 0.7946 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2610 1.7696 -0.5169 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1365 2.7584 -1.2219 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9379 4.2062 -0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4748 2.8771 0.3135 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7887 4.5575 0.7734 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1444 1.2307 0.6883 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3616 -2.3050 1.5627 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4744 -3.2610 2.2818 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1252 -0.9649 1.7336 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2999 1.3750 -0.0229 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6600 1.2062 1.0876 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1277 1.8346 1.6987 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8837 -4.9093 1.3598 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9930 -4.3555 2.8001 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6894 -4.8142 2.9431 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 1 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 1 0 14 17 1 0 9 18 1 0 18 19 2 0 18 20 1 0 20 21 1 0 21 22 2 0 22 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 26 27 1 0 23 28 1 0 7 2 1 0 16 8 1 0 15 11 1 0 26 21 1 0 1 29 1 0 1 30 1 0 1 31 1 0 3 32 1 0 4 33 1 0 6 34 1 0 7 35 1 0 8 36 1 1 9 37 1 6 16 38 1 0 17 39 1 0 17 40 1 0 17 41 1 0 20 42 1 0 22 43 1 0 24 44 1 0 25 45 1 0 27 46 1 0 27 47 1 0 27 48 1 0 28 49 1 0 28 50 1 0 28 51 1 0 M END