RDKit 3D 53 57 0 0 0 0 0 0 0 0999 V2000 4.1400 -1.2865 2.1454 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2946 -0.5659 1.1365 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2007 -0.0803 0.4796 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8537 -0.3313 0.8560 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2428 0.9495 1.3007 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2175 1.5235 0.3935 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7169 0.5349 -0.1148 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6616 1.2370 -0.9284 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5052 0.3933 -1.8046 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.7376 -0.7057 -2.5114 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9692 -1.4410 -1.4067 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.8558 -1.7561 -0.2564 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5107 -2.6907 0.5042 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0680 -1.0391 0.0045 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5992 -1.1342 1.3435 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2936 0.1287 1.7271 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2858 0.5133 0.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6667 0.7027 -0.6845 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6485 -0.2962 -1.0663 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0352 -0.3983 -0.8918 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1353 -1.0879 -0.1812 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6599 -0.2724 0.7004 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8359 -0.7019 1.2775 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9136 -0.2136 0.5751 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3742 0.5263 -0.4476 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0337 0.4834 -0.3620 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9364 -0.9890 1.7729 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 0.8592 2.3238 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0316 1.7435 1.4505 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 2.2949 0.9212 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6737 2.0008 -0.5171 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3377 1.8121 -0.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1055 1.9686 -1.5429 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9675 1.0481 -2.5821 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4577 -1.3692 -3.0042 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9832 -0.2656 -3.1785 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4785 -2.3400 -1.7783 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7956 -1.3257 2.0836 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2770 -2.0163 1.3993 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5935 0.9193 1.9952 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8989 -0.0887 2.6506 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7445 1.4762 0.9662 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1062 -0.2329 0.6643 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3069 1.7685 -0.7759 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5049 0.6451 -1.4407 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0506 -1.0504 -1.8048 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4338 0.1464 -1.7812 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7216 -2.0653 0.2103 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8811 -1.4243 -0.9629 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8750 -1.3405 2.1684 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9588 -0.3884 0.7991 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9155 1.0758 -1.2251 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3567 0.9590 -1.0129 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 20 1 0 20 21 1 0 11 12 1 0 12 13 2 0 12 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 2 22 1 0 22 23 2 0 23 24 1 0 24 25 2 0 25 26 1 0 21 4 1 0 19 14 1 0 26 22 1 0 20 7 1 0 19 9 1 0 4 27 1 1 5 28 1 0 5 29 1 0 6 30 1 0 6 31 1 0 8 32 1 0 8 33 1 0 9 34 1 6 10 35 1 0 10 36 1 0 11 37 1 6 20 47 1 6 21 48 1 0 21 49 1 0 15 38 1 0 15 39 1 0 16 40 1 0 16 41 1 0 17 42 1 0 17 43 1 0 18 44 1 0 18 45 1 0 19 46 1 6 23 50 1 0 24 51 1 0 25 52 1 0 26 53 1 0 M END