RDKit 3D 40 39 0 0 0 0 0 0 0 0999 V2000 4.8417 3.0838 0.8153 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0936 1.9341 0.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9694 1.7705 -0.8419 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5326 1.0357 1.3872 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5759 0.0154 0.7995 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3961 0.6335 0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3874 -0.2471 -0.4885 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3844 -1.2020 0.2919 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2348 -2.2933 1.0565 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0752 -3.2719 0.3011 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0443 -4.0696 -0.9461 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.7382 -1.9113 -0.7068 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.0429 -0.7728 -0.9449 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9281 -1.0456 -1.7322 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1216 0.5083 -0.2306 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4213 1.2474 -0.5698 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5427 1.5671 -1.9965 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6733 2.2439 -2.6028 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6374 1.1290 -2.7535 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6434 3.3982 0.2234 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5322 3.5339 1.7093 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9431 1.5928 2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3316 0.4994 1.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3620 -0.7005 1.5958 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1118 -0.5827 0.0051 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8455 1.2549 0.9563 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7564 1.4368 -0.5445 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9334 -0.7565 -1.3666 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2866 0.4524 -1.0698 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9156 -0.5555 1.1039 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7126 -2.0468 2.0064 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6438 -2.9765 1.4363 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3830 -4.0625 1.0241 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0189 -2.8561 -0.1036 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5950 -3.8524 -2.2191 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2960 1.1910 -0.3765 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2109 0.2884 0.8733 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2789 0.7065 -0.1579 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3545 2.2018 0.0175 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8439 1.4784 -3.6777 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 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 8 12 1 0 12 13 1 0 13 14 2 0 13 15 1 0 15 16 1 0 16 17 1 0 17 18 2 0 17 19 1 0 1 20 1 0 1 21 1 0 4 22 1 0 4 23 1 0 5 24 1 0 5 25 1 0 6 26 1 0 6 27 1 0 7 28 1 0 7 29 1 0 8 30 1 1 9 31 1 0 9 32 1 0 10 33 1 0 10 34 1 0 11 35 1 0 15 36 1 0 15 37 1 0 16 38 1 0 16 39 1 0 19 40 1 0 M END