RDKit 3D 51 52 0 0 0 0 0 0 0 0999 V2000 -4.3782 2.2202 0.3171 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5257 1.9468 -0.9284 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.9115 0.6242 -1.6104 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4581 -0.6004 -0.8044 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.9593 -0.5137 -0.4797 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6091 0.7713 0.1366 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0296 1.9637 -0.5882 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5625 0.9220 1.0586 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2213 2.0149 1.5168 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1024 -0.2948 1.6069 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1997 -0.5820 2.9496 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3573 -1.6925 3.5712 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2137 -2.5138 2.8481 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5269 -2.2172 1.5134 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0011 -1.0922 0.8488 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2855 -0.7451 -0.4347 N 0 0 0 0 0 2 0 0 0 0 0 0 2.4310 -1.3394 -1.3638 S 0 0 0 0 0 6 0 0 0 0 0 0 2.4858 -0.7548 -2.7029 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5994 -2.7948 -1.3578 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9246 -0.7326 -0.5721 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9638 0.7617 -0.2075 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2511 1.0518 0.5743 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8983 1.6824 -1.4269 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7743 -1.8927 -1.5611 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4461 2.2186 0.0671 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2154 1.4771 1.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1361 3.2058 0.7373 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7227 2.7640 -1.6349 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9963 0.5863 -1.7732 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4455 0.5953 -2.6047 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0158 -0.6227 0.1412 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6998 -1.3448 0.1822 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3634 -0.6121 -1.3967 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7856 2.8734 -0.0266 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4367 1.9963 -1.5119 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8692 0.0718 3.5005 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1292 -1.9132 4.6071 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6538 -3.3911 3.3133 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1986 -2.9034 0.9987 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0676 -1.3379 0.3307 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7495 -0.9805 -1.2533 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1229 1.0107 0.4511 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1398 0.8383 -0.0311 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2955 2.1041 0.8811 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3026 0.4385 1.4801 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9177 1.6382 -1.9085 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6630 1.4196 -2.1656 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0595 2.7260 -1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4503 -2.7682 -0.9894 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2740 -1.9190 -2.5364 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8542 -1.9865 -1.7306 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 1 0 5 6 1 0 6 7 1 0 6 8 1 0 8 9 2 0 8 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 1 0 17 18 2 0 17 19 2 0 17 20 1 0 20 21 1 0 21 22 1 0 21 23 1 0 4 24 1 0 7 2 1 0 15 10 1 0 1 25 1 0 1 26 1 0 1 27 1 0 2 28 1 6 3 29 1 0 3 30 1 0 4 31 1 1 5 32 1 0 5 33 1 0 7 34 1 0 7 35 1 0 11 36 1 0 12 37 1 0 13 38 1 0 14 39 1 0 20 40 1 0 20 41 1 0 21 42 1 0 22 43 1 0 22 44 1 0 22 45 1 0 23 46 1 0 23 47 1 0 23 48 1 0 24 49 1 0 24 50 1 0 24 51 1 0 M CHG 1 16 -1 M END