RDKit 3D 50 50 0 0 0 0 0 0 0 0999 V2000 0.8788 -3.9142 -2.1681 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9046 -3.0573 -0.9258 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0737 -2.5428 -0.4896 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3290 -1.6519 0.6929 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9115 -0.2754 0.3159 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0151 0.6455 -0.5560 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0636 0.1694 -1.9963 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0635 -0.2199 -2.5815 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9021 0.2448 -2.6614 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 0.7834 0.0138 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.3543 1.7543 -0.7233 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1068 2.3262 0.3915 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3862 2.9750 0.1734 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5235 2.3929 1.0518 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.4734 2.9519 2.3709 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5557 0.8659 1.1878 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7660 0.1301 -0.1247 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6000 -1.2755 0.0794 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4557 2.1904 1.5807 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8043 2.6873 2.7060 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6039 1.3715 1.3611 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4461 -2.8681 -0.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2190 -2.0353 -1.1386 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8758 -4.0526 -2.5997 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2486 -3.4558 -2.9371 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4797 -4.9071 -1.9358 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9760 -2.7768 -1.0587 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4414 -1.5253 1.3173 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0602 -2.1624 1.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1451 0.2520 1.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8803 -0.4249 -0.1791 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4806 1.6411 -0.5687 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0923 -0.1772 -3.5272 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1015 -0.1837 0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1897 2.5504 -1.2436 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0035 1.2315 -1.4301 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6720 2.8728 -0.8802 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2771 4.0474 0.3735 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4776 2.7298 0.6299 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5217 2.9189 2.6417 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3584 0.5859 1.8839 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6502 0.4964 1.6839 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7711 0.3068 -0.5209 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0460 0.4316 -0.8864 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2721 -1.5392 0.7357 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1165 2.4029 3.4081 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1777 1.0123 2.1071 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3934 -2.4068 0.7013 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9544 -3.8316 -0.1745 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0814 -1.8966 -0.6883 H 0 0 0 0 0 0 0 0 0 0 0 0 14 15 1 0 10 6 1 0 13 14 1 0 6 5 1 0 13 12 1 0 5 4 1 0 19 21 1 0 4 3 1 0 16 17 1 0 3 2 2 0 2 1 1 0 17 18 1 0 6 7 1 0 14 16 1 0 19 20 2 3 10 21 1 0 7 8 2 0 10 11 1 0 7 9 1 0 11 12 1 0 2 22 1 0 12 19 1 0 22 23 1 0 13 37 1 0 13 38 1 0 14 39 1 6 16 41 1 0 16 42 1 0 17 43 1 0 17 44 1 0 18 45 1 0 15 40 1 0 21 47 1 0 10 34 1 1 11 35 1 0 11 36 1 0 6 32 1 6 5 30 1 0 5 31 1 0 4 28 1 0 4 29 1 0 3 27 1 0 1 24 1 0 1 25 1 0 1 26 1 0 20 46 1 0 9 33 1 0 22 48 1 0 22 49 1 0 23 50 1 0 M END