RDKit 3D 46 49 0 0 0 0 0 0 0 0999 V2000 -3.0062 -0.5307 1.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9249 -0.6915 0.1859 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.2368 -1.9258 -0.2434 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8195 -1.8465 -0.6066 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2245 -0.5041 -0.8663 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2283 -0.4505 -0.7675 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0031 -1.5694 -0.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3952 -1.4954 -0.8713 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0195 -0.3115 -0.5697 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4151 -0.2130 -0.4643 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2031 -0.4680 1.0193 S 0 0 2 0 0 6 0 0 0 0 0 0 7.5652 -1.0467 0.7352 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4159 -1.4094 1.8887 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3654 1.0213 1.7695 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2451 0.8069 -0.3663 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8477 0.7395 -0.4648 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1465 2.0187 -0.2211 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3293 1.9406 -0.3238 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9025 0.5832 -0.0450 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.3159 0.5066 -0.4989 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.2316 1.5839 -0.1201 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5906 0.9155 -0.3073 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3207 -0.5502 -0.3126 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0563 -1.4527 -0.6444 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6297 -1.4042 2.0427 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0515 -0.6249 2.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5919 0.3600 1.9445 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8406 -2.3687 -1.0917 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3785 -2.6822 0.5867 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6285 -2.5051 -1.5019 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1864 -2.3275 0.1988 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4838 -0.2464 -1.9383 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5922 -2.5396 -1.2122 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0283 -2.3592 -1.0264 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5959 1.7182 1.0915 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7526 1.7287 -0.1302 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5041 2.4074 0.7706 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5146 2.7600 -0.9725 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7710 2.6360 0.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7316 2.2713 -1.3085 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7220 0.3431 1.0021 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3847 0.3270 -1.5902 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1057 2.0227 0.8745 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1162 2.4265 -0.8644 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9579 1.2094 -1.3106 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2990 1.1971 0.4948 H 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 1 2 3 1 0 3 4 1 0 4 5 1 0 5 19 1 0 19 18 1 0 18 17 1 0 17 16 1 0 16 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 1 0 11 10 1 6 11 14 1 0 11 12 2 0 11 13 2 0 9 15 2 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 2 0 20 2 1 0 23 2 1 0 6 5 1 0 15 16 1 0 1 25 1 0 1 26 1 0 1 27 1 0 3 28 1 0 3 29 1 0 4 30 1 0 4 31 1 0 5 32 1 6 19 41 1 1 18 39 1 0 18 40 1 0 17 37 1 0 17 38 1 0 7 33 1 0 8 34 1 0 14 35 1 0 15 36 1 0 20 42 1 6 21 43 1 0 21 44 1 0 22 45 1 0 22 46 1 0 M END