DA29IM -OEChem-01102402183D 31 33 0 0 0 0 0 0 0999 V2000 4.2559 -0.2416 2.7143 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.2354 -0.2605 -2.7235 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.2200 -2.0237 0.0066 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.4148 -2.6735 -1.2708 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4306 -2.6720 1.2821 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0077 2.4685 -0.0012 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4015 -0.6688 -0.0077 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8972 0.2851 0.0095 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6463 -1.1724 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1293 -0.5414 0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2959 0.5795 0.0028 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1126 1.2469 0.0042 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5111 -0.4844 -0.0065 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8956 1.8337 -0.0011 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4947 0.7458 0.0024 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0967 0.7769 -0.0109 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2955 1.9271 -0.0079 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1460 0.5050 -1.2073 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1546 0.5110 1.2086 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4658 0.0353 1.2053 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4572 0.0292 -1.2107 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1171 -0.2056 -0.0045 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0848 -1.4530 -0.8788 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0985 -1.4459 0.9214 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1205 -1.3807 -0.0084 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3270 2.7555 0.0012 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1787 0.8735 -0.0162 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7664 2.9069 -0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6267 0.6893 -2.1453 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6419 0.7007 2.1493 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6941 -0.7713 0.9145 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 2 21 1 0 0 0 0 3 4 2 0 0 0 0 3 5 2 0 0 0 0 3 9 1 0 0 0 0 3 10 1 0 0 0 0 6 12 2 0 0 0 0 7 22 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 12 1 0 0 0 0 9 23 1 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 13 2 0 0 0 0 11 14 2 0 0 0 0 12 15 1 0 0 0 0 13 16 1 0 0 0 0 13 25 1 0 0 0 0 14 17 1 0 0 0 0 14 26 1 0 0 0 0 15 18 2 0 0 0 0 15 19 1 0 0 0 0 16 17 2 0 0 0 0 16 27 1 0 0 0 0 17 28 1 0 0 0 0 18 21 1 0 0 0 0 18 29 1 0 0 0 0 19 20 2 0 0 0 0 19 30 1 0 0 0 0 20 22 1 0 0 0 0 21 22 2 0 0 0 0 M END $$$$