RDKit 3D 47 49 0 0 0 0 0 0 0 0999 V2000 4.4985 -2.8798 1.3626 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9484 -2.1793 0.0941 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0460 -1.1143 -0.2305 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9525 -1.4738 -0.9566 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7112 -2.5944 -1.3788 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0797 -0.2901 -1.1421 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4394 0.9299 -1.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2927 1.9293 -1.6280 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1238 1.3601 -0.7859 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3889 -0.4528 -0.8030 S 0 0 0 0 0 0 0 0 0 0 0 0 0.1359 1.8076 0.5943 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1146 3.1386 0.8726 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1006 4.0023 -0.0072 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3330 3.4854 2.3378 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0992 3.5090 2.7461 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.4260 1.7742 2.4869 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4046 1.3169 1.7104 N 0 0 0 0 0 2 0 0 0 0 0 0 -3.1034 0.0230 1.4753 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9162 -0.2836 2.0627 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5196 0.8186 2.7593 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9620 -0.9684 0.6001 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5172 -2.2760 0.3865 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2745 -3.1487 -0.3968 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4742 -2.7151 -0.9642 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9186 -1.4089 -0.7507 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1625 -0.5338 0.0311 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8695 2.1490 -3.0255 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5829 2.3236 -4.1381 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7999 1.3832 -1.9968 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5155 -3.3422 1.2289 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2131 -3.6556 1.6513 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4039 -2.1627 2.1846 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0518 -2.8840 -0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9325 -1.7267 0.2541 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6511 2.8809 -1.2209 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8605 1.5967 -1.2067 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3108 1.1453 1.2542 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2295 2.8067 2.9868 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0767 4.4870 2.5077 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5788 -2.6066 0.8262 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9231 -4.1624 -0.5642 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0612 -3.3946 -1.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8500 -1.0677 -1.1923 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4999 0.4861 0.2002 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5189 0.5624 -2.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7605 1.8474 -2.9875 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1880 2.1207 -1.2873 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 1 0 6 7 2 0 7 8 1 0 8 9 1 0 9 10 1 0 9 11 1 0 11 12 1 0 12 13 2 0 12 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 19 20 1 0 18 21 1 0 21 22 2 0 22 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 8 27 1 0 27 28 3 0 7 29 1 0 10 6 1 0 20 16 2 0 26 21 1 0 1 30 1 0 1 31 1 0 1 32 1 0 2 33 1 0 2 34 1 0 8 35 1 1 9 36 1 6 11 37 1 0 14 38 1 0 14 39 1 0 22 40 1 0 23 41 1 0 24 42 1 0 25 43 1 0 26 44 1 0 29 45 1 0 29 46 1 0 29 47 1 0 M CHG 1 17 -1 M END