B3DOU5 -OEChem-04022118063D 28 29 0 0 0 0 0 0 0999 V2000 -4.1421 2.2421 0.9411 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -6.0192 -0.2384 0.0491 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.7052 -0.6823 0.6819 S 0 0 0 0 0 0 0 0 0 0 0 0 4.8074 -0.0546 -0.4070 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3167 -2.0019 1.1506 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4982 0.4828 1.5252 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7853 2.5412 -0.6916 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6179 2.1767 -0.1119 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0832 -0.4072 -0.8717 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4284 -0.7318 0.2873 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5548 -0.3503 -0.6357 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1728 0.3582 -0.1072 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2104 -1.9213 0.3443 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1218 0.7713 -0.0304 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3643 -1.4189 -1.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5226 -1.6955 -0.0087 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4983 0.8243 0.1895 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7407 -1.3660 -0.8009 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3077 -0.2444 -0.1958 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7673 1.7160 -0.2872 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2674 0.5213 -1.3248 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1882 -1.2337 -1.5368 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8410 -2.8986 0.6275 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4953 1.6143 0.2511 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9361 -2.2997 -1.4919 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3275 -2.4155 -0.0521 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3564 -2.2081 -1.1071 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4773 3.4655 -0.8067 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 2 19 1 0 0 0 0 3 5 2 0 0 0 0 3 6 2 0 0 0 0 3 9 1 0 0 0 0 3 10 1 0 0 0 0 4 12 1 0 0 0 0 4 16 1 0 0 0 0 7 20 1 0 0 0 0 7 28 1 0 0 0 0 8 20 2 0 0 0 0 9 11 1 0 0 0 0 9 21 1 0 0 0 0 9 22 1 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 11 14 2 0 0 0 0 11 15 1 0 0 0 0 12 20 1 0 0 0 0 13 16 2 0 0 0 0 13 23 1 0 0 0 0 14 17 1 0 0 0 0 14 24 1 0 0 0 0 15 18 2 0 0 0 0 15 25 1 0 0 0 0 16 26 1 0 0 0 0 17 19 2 0 0 0 0 18 19 1 0 0 0 0 18 27 1 0 0 0 0 M END $$$$