RDKit 3D 49 49 0 0 0 0 0 0 0 0999 V2000 3.0334 2.8387 0.2029 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1799 2.3251 -0.9462 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0125 1.5315 -1.9398 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1369 1.0652 -3.4328 S 0 0 0 0 0 0 0 0 0 0 0 0 1.5551 2.2555 -4.0141 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0357 0.2276 -4.2011 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8972 0.0819 -2.8802 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4320 0.6596 -2.6179 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3951 -0.4061 -2.1039 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8603 -1.1291 -0.8526 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6417 -1.4323 -0.9674 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1832 -1.2664 -2.3807 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1432 -0.3076 0.4121 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4350 0.8874 0.3187 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0481 -0.9208 1.6607 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7715 -2.3440 1.8974 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6379 -2.5894 2.4182 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3106 -0.0878 2.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7616 -0.1626 3.3628 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.7708 0.4619 2.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8399 0.5096 4.6726 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8906 1.0217 5.7125 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8218 3.5053 -0.1608 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5038 2.0102 0.7421 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4161 3.3988 0.9123 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6959 3.1736 -1.4422 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3864 1.6969 -0.5321 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8687 2.1265 -2.2786 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4049 0.6153 -1.4871 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3570 1.4847 -1.9067 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8338 1.0639 -3.5541 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5560 -1.1496 -2.8965 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3757 0.0444 -1.9085 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4335 -2.0604 -0.7848 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8324 -2.4610 -0.6404 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 -0.7840 -0.2935 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2595 -1.4670 -2.3721 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7339 -2.0011 -3.0586 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9176 -2.9256 0.9868 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5036 -2.7188 2.6209 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7846 -2.1422 3.4057 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8235 -3.6642 2.5101 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3931 -2.1671 1.7496 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 -0.4048 3.6371 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0474 0.9557 2.6327 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0399 -1.2138 3.5044 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7809 0.4431 2.8275 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5259 1.5077 2.1849 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8079 -0.0862 1.4544 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 4 5 2 0 4 6 2 0 4 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 10 13 1 0 13 14 2 0 13 15 1 0 15 16 1 0 16 17 1 0 15 18 1 0 18 19 1 0 19 20 1 0 19 21 1 0 21 22 3 0 12 7 1 0 1 23 1 0 1 24 1 0 1 25 1 0 2 26 1 0 2 27 1 0 3 28 1 0 3 29 1 0 8 30 1 0 8 31 1 0 9 32 1 0 9 33 1 0 10 34 1 0 11 35 1 0 11 36 1 0 12 37 1 0 12 38 1 0 16 39 1 0 16 40 1 0 17 41 1 0 17 42 1 0 17 43 1 0 18 44 1 0 18 45 1 0 19 46 1 1 20 47 1 0 20 48 1 0 20 49 1 0 M END