B0C3QN -OEChem-04042104573D 26 27 0 0 0 0 0 0 0999 V2000 -5.2266 1.8684 0.5644 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.9352 -1.9538 -1.6309 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3788 0.9589 1.1566 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0114 1.2275 -0.2968 O 0 5 0 0 0 0 0 0 0 0 0 0 3.5053 1.5165 -1.8677 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8931 -0.1505 -0.5648 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6327 1.2847 0.8114 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8807 0.9962 -0.7894 N 0 3 0 0 0 0 0 0 0 0 0 0 0.8495 -1.0209 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5438 -0.5724 -0.2626 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4458 -1.3003 -0.5093 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7366 -0.1541 -0.6329 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2671 -1.6062 1.2401 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8287 -0.9787 -0.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4324 0.6118 0.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9988 0.1181 -0.1054 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5293 -1.3341 1.7674 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3953 -0.4720 1.0947 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8568 0.9609 0.2563 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4879 -2.1736 -1.1555 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4118 0.2977 -1.5691 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6062 -2.2814 1.7799 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8375 -1.7935 2.7021 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7940 -0.3871 -0.9713 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6083 2.1020 1.4148 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3707 -0.2832 1.5356 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 2 0 0 0 0 2 14 2 0 0 0 0 3 15 2 0 0 0 0 4 8 1 0 0 0 0 5 8 2 0 0 0 0 6 14 1 0 0 0 0 6 19 1 0 0 0 0 6 24 1 0 0 0 0 7 15 1 0 0 0 0 7 19 1 0 0 0 0 7 25 1 0 0 0 0 8 16 1 0 0 0 0 9 11 1 0 0 0 0 9 12 2 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 10 15 1 0 0 0 0 11 20 1 0 0 0 0 12 16 1 0 0 0 0 12 21 1 0 0 0 0 13 17 2 0 0 0 0 13 22 1 0 0 0 0 16 18 2 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 18 26 1 0 0 0 0 M CHG 2 4 -1 8 1 M END $$$$