RDKit 3D 51 53 0 0 0 0 0 0 0 0999 V2000 -1.6147 6.6534 -0.1824 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2743 5.1975 -0.1797 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7839 4.5815 0.9758 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4166 3.2319 0.9559 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5276 2.4584 -0.2157 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9881 3.0967 -1.3724 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3561 4.4473 -1.3577 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1439 0.9568 -0.1784 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.0893 -0.0130 -0.9532 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2594 -0.2795 -2.2725 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0925 -1.2966 -2.6366 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6545 -2.2230 -1.8114 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4718 -3.5175 -2.5314 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.5138 -1.9797 -0.4579 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0723 -0.7222 -0.0483 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5729 -0.1673 0.9401 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1367 -2.8083 0.5627 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3906 -4.1015 0.7998 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0710 -4.2840 0.6496 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8143 0.1574 -3.3625 O 0 0 0 0 0 1 0 0 0 0 0 0 1.3596 0.5105 -0.0243 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5591 1.2043 -0.6569 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7763 0.7859 -0.5343 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0526 -0.3332 0.1951 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6961 -0.8518 0.1773 S 0 0 0 0 0 0 0 0 0 0 0 0 3.0308 -0.9620 0.9412 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6776 -0.5213 0.8328 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9063 -1.1927 1.5880 O 0 0 0 0 0 1 0 0 0 0 0 0 3.3652 -2.1231 1.8007 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2469 -3.4145 1.0217 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1935 -4.3573 0.9159 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2382 2.2374 -1.2687 O 0 0 0 0 0 1 0 0 0 0 0 0 -1.9794 6.9716 0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4073 6.8683 -0.9068 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7311 7.2456 -0.4396 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6596 5.1396 1.8969 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0132 2.7632 1.8512 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0168 2.5434 -2.3075 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6788 4.8975 -2.2903 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4773 0.7855 0.8577 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0827 -1.4321 -3.6358 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1609 -3.0403 0.2491 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2178 -2.2923 1.5255 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9960 -4.9379 1.1306 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4191 -3.4605 0.3489 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5946 -5.2348 0.8473 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3742 -2.0126 2.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7342 -2.1675 2.6962 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2960 -3.5327 0.5037 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1549 -4.2386 1.4005 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0173 -5.2358 0.3077 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 2 0 5 8 1 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 1 0 12 13 2 0 12 14 1 0 14 15 1 0 15 16 2 0 14 17 1 0 17 18 1 0 18 19 2 0 10 20 1 0 8 21 1 0 21 22 1 0 22 23 2 0 23 24 1 0 24 25 2 0 24 26 1 0 26 27 1 0 27 28 1 0 26 29 1 0 29 30 1 0 30 31 2 0 22 32 1 0 7 2 1 0 15 9 1 0 27 21 2 0 1 33 1 0 1 34 1 0 1 35 1 0 3 36 1 0 4 37 1 0 6 38 1 0 7 39 1 0 8 40 1 1 11 41 1 0 17 42 1 0 17 43 1 0 18 44 1 0 19 45 1 0 19 46 1 0 29 47 1 0 29 48 1 0 30 49 1 0 31 50 1 0 31 51 1 0 M CHG 3 20 -1 28 -1 32 -1 M END