RDKit 3D 44 45 0 0 0 0 0 0 0 0999 V2000 2.9001 3.2056 0.9069 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0430 2.0787 0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3637 0.7452 1.0258 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7934 -0.5336 0.3747 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1150 -0.7090 -1.1136 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9939 -2.2116 -1.3621 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2536 -2.8484 -0.0321 N 0 0 0 0 0 4 0 0 0 0 0 0 2.5222 -1.7560 0.9624 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2883 -0.7189 0.6334 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1176 -1.6901 1.2672 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5558 0.1862 0.0384 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0211 0.2374 0.2695 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.7063 -1.1042 -0.0844 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2036 -0.8464 -0.1945 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3411 0.7650 -0.9374 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.1862 1.5935 -0.1065 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5558 0.6018 -2.3595 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6480 1.2637 -0.6948 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2873 0.6462 1.7295 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9638 3.0161 0.7305 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6410 4.1542 0.4263 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7437 3.3162 1.9847 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2106 2.0149 -0.7358 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9963 2.3490 0.5083 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4576 0.6526 1.0679 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0257 0.7979 2.0696 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1431 -0.3882 -1.3249 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4529 -0.1494 -1.7817 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7346 -2.5852 -2.0741 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9858 -2.5056 -1.6693 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0093 -3.5463 -0.0583 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4013 -3.3454 0.2815 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6105 -1.6283 0.9804 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1797 -2.0929 1.9453 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1538 1.0004 -0.4101 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5137 -1.8912 0.6511 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3283 -1.4664 -1.0498 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6791 -0.8127 0.7894 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7068 -1.5855 -0.8215 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6172 2.2883 -0.3145 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1627 1.2353 -1.6769 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7671 1.5808 1.9705 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3509 0.8008 1.9341 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9268 -0.1146 2.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 4 3 1 1 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 4 9 1 0 9 10 2 0 9 11 1 0 12 11 1 1 12 13 1 0 13 14 1 0 14 15 1 0 15 16 2 0 15 17 2 0 15 18 1 0 12 19 1 0 8 4 1 0 18 12 1 0 1 20 1 0 1 21 1 0 1 22 1 0 2 23 1 0 2 24 1 0 3 25 1 0 3 26 1 0 5 27 1 0 5 28 1 0 6 29 1 0 6 30 1 0 7 31 1 0 7 32 1 0 8 33 1 0 8 34 1 0 11 35 1 0 13 36 1 0 13 37 1 0 14 38 1 0 14 39 1 0 18 40 1 0 18 41 1 0 19 42 1 0 19 43 1 0 19 44 1 0 M CHG 1 7 1 M END