RDKit 3D 55 57 0 0 0 0 0 0 0 0999 V2000 3.3562 1.8118 -0.0277 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2612 0.7644 -1.1184 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2139 -0.2956 -0.7374 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9159 0.4594 -0.5891 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2483 -0.4308 -0.2098 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3941 -1.4490 -1.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0159 -1.1514 1.0769 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2561 -2.6324 0.8465 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9721 -1.0224 2.1756 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0593 0.0150 2.0656 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5688 -0.0891 0.6434 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.1705 -1.4278 0.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3128 -1.3868 1.2686 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7801 -0.0508 1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8521 0.4145 1.6731 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8187 0.7105 0.4005 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9065 1.7497 -0.3761 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7238 2.2693 -1.1399 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.9435 2.9837 -0.2422 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9266 0.9811 -1.4996 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4796 0.4280 -0.1948 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6119 0.1320 -1.3479 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1431 -0.5301 -0.1494 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7111 -1.6769 0.1387 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0896 0.0546 0.6647 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0579 1.4239 0.9639 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3886 2.2032 0.0895 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6637 2.6466 -0.2604 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9185 1.2105 -2.0688 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5851 -0.7149 0.2208 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2188 -1.0167 -1.5618 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1044 1.2400 0.2014 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7816 1.0180 -1.5268 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3491 -1.9769 -1.3178 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3720 -0.8644 -2.2844 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4992 -2.1205 -1.3934 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9825 -0.7717 1.4668 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3212 -2.8220 0.6072 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4349 -3.0982 0.1291 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0901 -3.1574 1.8273 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4692 -0.8189 3.1692 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5090 -1.9976 2.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5991 1.0065 2.1976 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8254 -0.2225 2.8189 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5913 -1.4491 -0.6295 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6124 -2.2975 0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8325 2.2841 -0.5042 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9943 2.7908 -2.0509 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 3.0429 0.6658 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5712 0.2996 -2.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0699 1.3647 -2.0703 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1162 1.3618 0.3786 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2838 0.9408 -1.7042 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4899 -0.5847 -2.1852 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9191 0.4486 0.2764 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 5 4 1 6 5 6 1 0 5 7 1 0 7 8 1 0 7 9 1 0 9 10 1 0 11 10 1 1 11 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 14 16 1 0 16 17 2 0 17 18 1 0 18 19 1 0 18 20 1 0 20 21 1 0 2 22 1 0 22 23 1 0 23 25 1 0 23 24 2 0 21 5 1 0 16 11 1 0 21 11 1 0 1 26 1 0 1 27 1 0 1 28 1 0 2 29 1 6 3 30 1 0 3 31 1 0 4 32 1 0 4 33 1 0 6 34 1 0 6 35 1 0 6 36 1 0 7 37 1 1 8 38 1 0 8 39 1 0 8 40 1 0 9 41 1 0 9 42 1 0 10 43 1 0 10 44 1 0 12 45 1 0 12 46 1 0 17 47 1 0 18 48 1 6 19 49 1 0 20 50 1 0 20 51 1 0 21 52 1 1 22 53 1 0 22 54 1 0 25 55 1 0 M END