RDKit 3D 47 51 0 0 0 0 0 0 0 0999 V2000 4.2258 -1.9362 0.5192 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4578 -0.5964 0.1646 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3936 0.3099 0.1367 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1256 -0.1241 0.4588 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0853 0.7825 0.4256 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3096 2.0948 0.0803 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5792 2.5386 -0.2444 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6228 1.6445 -0.2164 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9157 2.0421 -0.5348 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2064 3.0902 0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4592 4.2641 -0.2427 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0201 2.5675 0.4387 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2758 1.2293 0.0747 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.7349 0.8710 0.4103 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.5725 1.0149 -0.6627 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5016 2.0230 -0.5281 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7211 -0.4022 1.1022 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.0630 -1.6569 0.8258 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9293 -1.3355 0.1894 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.9905 -1.3872 -1.2466 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5485 -1.5097 -1.6814 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 -1.7393 -0.4698 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1892 -3.1979 -0.2632 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5514 -1.1186 0.5963 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2906 0.3580 0.7669 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3693 0.6300 2.1610 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8363 -2.0303 1.5539 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1070 -2.5762 0.3777 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4206 -2.3186 -0.1552 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9944 -1.1781 0.7522 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7355 3.5654 -0.5121 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1158 2.9819 -0.7902 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1604 1.2063 -1.0421 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0683 1.6717 1.1441 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1521 2.1125 -1.3965 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0539 1.8344 0.4225 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9846 3.0067 -0.3951 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3946 -0.3168 2.1861 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5647 -2.3268 -1.5501 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4373 -0.6076 -1.8522 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4821 -2.3614 -2.3891 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1891 -0.6238 -2.2467 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2468 -3.7225 -1.2261 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8057 -3.4132 0.1886 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9443 -3.5112 0.4653 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3282 -1.6702 1.5285 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0088 -0.1785 2.6022 H 0 0 0 0 0 0 0 0 0 0 0 0 16 15 1 0 15 14 1 0 14 17 1 0 17 18 1 0 19 18 1 1 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 22 24 1 0 24 25 1 0 25 26 1 1 25 13 1 0 13 12 1 0 12 10 1 0 10 11 2 0 10 6 1 0 6 7 2 0 7 8 1 0 8 9 1 0 8 3 2 0 3 2 1 0 2 1 1 0 3 4 1 0 4 5 2 0 13 14 1 0 5 6 1 0 19 17 1 0 24 19 1 0 5 25 1 0 16 35 1 0 16 36 1 0 16 37 1 0 14 34 1 1 17 38 1 1 20 39 1 0 20 40 1 0 21 41 1 0 21 42 1 0 23 43 1 0 23 44 1 0 23 45 1 0 24 46 1 1 26 47 1 0 13 33 1 6 7 31 1 0 9 32 1 0 1 27 1 0 1 28 1 0 1 29 1 0 4 30 1 0 M END