RDKit 3D 60 62 0 0 0 0 0 0 0 0999 V2000 5.8002 3.0124 -0.1163 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1829 2.0110 -1.1337 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3914 2.1623 -2.3747 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3970 0.4120 -0.5680 S 0 0 0 0 0 0 0 0 0 0 0 0 7.2208 0.4632 0.6248 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7828 -0.4231 -1.6884 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7562 -0.0640 -0.0739 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3514 0.1205 1.2533 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0250 -0.1316 1.6034 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1180 -0.5591 0.6264 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5542 -0.8333 -0.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8799 -0.5893 -1.0287 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6983 -0.7244 1.0023 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4225 -1.3653 2.0171 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3682 -0.1423 0.1484 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2815 0.9423 -0.6478 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7024 1.1109 -1.1681 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1307 2.0062 -1.8835 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4676 0.0607 -0.6843 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7222 -0.7614 0.2300 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.7630 -2.2291 -0.1747 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4390 -2.6367 -1.4832 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4545 -3.9858 -1.8427 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7946 -4.9544 -0.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1179 -4.5593 0.4048 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1020 -3.2078 0.7734 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4909 -5.5750 1.3927 N 0 0 0 0 0 4 0 0 0 0 0 0 -3.0945 -5.2006 2.4086 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2043 -6.7559 1.1425 O 0 0 0 0 0 1 0 0 0 0 0 0 -3.9138 0.0169 -0.8023 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6677 0.4081 0.4793 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1516 1.5570 1.1487 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3172 2.7793 0.4331 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4015 3.6245 1.0985 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6020 4.8576 0.4169 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6265 1.7590 -0.9601 O 0 0 0 0 0 1 0 0 0 0 0 0 6.4232 2.9252 0.7785 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7457 2.9180 0.1596 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9625 4.0182 -0.5176 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6971 1.4335 -3.1299 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3204 2.0639 -2.1805 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5728 3.1544 -2.8017 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0427 0.4994 2.0009 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6801 0.0513 2.6179 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8485 -1.1703 -1.4314 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1992 -0.7507 -2.0547 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1360 -0.6182 1.2354 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1651 -1.8891 -2.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1961 -4.2757 -2.8589 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8018 -6.0017 -1.1921 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3280 -2.9079 1.7955 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2121 0.6826 -1.6193 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2073 -0.9949 -1.1039 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7334 0.5514 0.2667 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5976 -0.4188 1.1949 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3652 3.3220 0.4701 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5554 2.6301 -0.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3527 3.0813 1.1148 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1395 3.8386 2.1401 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7222 5.2521 0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 2 0 4 6 2 0 4 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 10 13 1 0 13 14 2 0 13 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 17 19 1 0 19 20 1 0 20 21 1 0 21 22 2 0 22 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 25 27 1 0 27 28 2 0 27 29 1 0 19 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 16 36 1 0 12 7 1 0 20 15 1 0 26 21 1 0 1 37 1 0 1 38 1 0 1 39 1 0 3 40 1 0 3 41 1 0 3 42 1 0 8 43 1 0 9 44 1 0 11 45 1 0 12 46 1 0 20 47 1 1 22 48 1 0 23 49 1 0 24 50 1 0 26 51 1 0 30 52 1 0 30 53 1 0 31 54 1 0 31 55 1 0 33 56 1 0 33 57 1 0 34 58 1 0 34 59 1 0 35 60 1 0 M CHG 3 27 1 29 -1 36 -1 M END