RDKit 3D 41 42 0 0 0 0 0 0 0 0999 V2000 4.0691 -0.1066 -0.1876 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0843 0.6296 0.2985 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2622 2.0028 0.6993 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3902 2.5228 0.5847 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7002 0.0667 0.4636 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7543 0.8916 -0.3725 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4489 1.1953 -1.5672 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4844 0.1528 -0.7605 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.5897 1.1558 -0.8794 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0450 1.5973 -2.0245 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1717 1.6492 0.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7018 0.4120 1.1241 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5077 -0.4423 1.4494 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.9460 -1.5828 2.1510 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8748 -0.9420 0.1735 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.9788 -1.7466 -0.5318 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2535 -1.8849 0.4277 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5996 -1.3488 0.0211 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8086 -1.4692 -1.3609 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9506 -1.1294 -0.4897 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0369 0.3491 -0.2829 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4525 2.5712 1.0871 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4933 0.1212 1.5454 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5387 1.8900 0.0892 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 1.3509 -2.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3865 -0.3038 -1.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8457 2.3218 -2.0304 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6594 1.2734 -2.9844 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3564 2.0548 1.0503 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9765 2.3836 0.2235 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1378 0.7571 2.0656 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4163 -0.1216 0.4652 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8441 0.1024 2.1042 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9634 -1.3962 3.1239 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5215 -2.5444 -1.1727 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5918 -1.1175 -1.1818 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6242 -2.2653 0.1913 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2889 -2.1069 1.5059 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1358 -2.8693 -0.0952 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3829 -1.9441 0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1709 -2.1300 -1.7465 H 0 0 0 0 0 0 0 0 0 0 0 0 15 16 1 6 15 17 1 0 17 18 1 0 18 19 1 0 18 5 1 0 5 6 1 0 6 7 1 0 6 8 1 0 8 9 1 0 9 10 2 3 9 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 5 2 1 0 2 1 2 3 2 3 1 0 3 4 2 0 8 15 1 0 13 15 1 0 16 35 1 0 16 36 1 0 16 37 1 0 17 38 1 0 17 39 1 0 18 40 1 1 19 41 1 0 5 23 1 1 6 24 1 1 7 25 1 0 8 26 1 6 10 27 1 0 10 28 1 0 11 29 1 0 11 30 1 0 12 31 1 0 12 32 1 0 13 33 1 1 14 34 1 0 1 20 1 0 1 21 1 0 3 22 1 0 M END