RDKit 3D 41 42 0 0 0 0 0 0 0 0999 V2000 -2.2377 0.6698 -2.1351 C 0 0 0 0 0 3 0 0 0 0 0 0 -1.4974 0.2932 -1.3050 N 0 0 0 0 0 4 0 0 0 0 0 0 -0.6086 -0.1217 -0.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2806 -0.6264 0.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7306 -0.7093 0.7734 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5167 -0.1115 1.7278 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9247 -0.2425 1.7192 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5466 -0.9819 0.7437 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9305 -1.1677 0.6606 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.9151 -0.1747 -0.3067 S 0 0 0 0 0 6 0 0 0 0 0 0 -9.0059 0.4998 0.4458 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.5695 -1.0753 -1.3315 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9720 1.0065 -1.0817 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7578 -1.5837 -0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3731 -1.4614 -0.2211 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7474 -0.0302 -0.3318 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9631 0.0522 -0.3525 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3461 0.1471 -0.3792 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1226 -0.1791 -1.4954 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4922 -0.1197 -1.4307 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1338 0.2543 -0.2944 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5064 0.3098 -0.2311 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1375 0.7102 0.9619 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4003 0.5905 0.8486 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0455 0.5261 0.7711 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7077 0.5361 -1.9872 N 0 0 0 0 0 4 0 0 0 0 0 0 0.7076 0.9115 -3.0950 C 0 0 0 0 0 3 0 0 0 0 0 0 -0.6536 -0.9253 1.5981 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0561 0.4822 2.5161 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5367 0.2283 2.4685 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1148 1.9080 -0.6465 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2658 -2.1551 -0.9682 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7531 -1.9295 -0.9693 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9169 1.1918 -1.2424 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6708 -0.4793 -2.4299 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0739 -0.3836 -2.3361 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8310 1.7441 1.2823 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2342 0.6803 0.8006 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8212 0.0478 1.8189 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9308 0.8793 1.7488 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4579 0.7889 1.6503 H 0 0 0 0 0 0 0 0 0 0 0 0 23 22 1 0 22 21 1 0 21 20 2 0 20 19 1 0 19 18 2 0 18 17 1 0 17 16 2 0 16 26 1 0 26 27 3 0 16 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 1 0 10 13 1 0 10 11 2 0 10 12 2 0 8 14 1 0 14 15 2 0 3 2 1 0 2 1 3 0 18 25 1 0 25 24 2 0 24 21 1 0 15 5 1 0 23 37 1 0 23 38 1 0 23 39 1 0 20 36 1 0 19 35 1 0 17 34 1 0 4 28 1 0 6 29 1 0 7 30 1 0 13 31 1 0 14 32 1 0 15 33 1 0 25 41 1 0 24 40 1 0 M CHG 4 1 -1 2 1 26 1 27 -1 M END