B5K8EU -OEChem-04012115163D 50 52 0 1 0 0 0 0 0999 V2000 -3.0225 1.7821 -1.6081 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.4350 1.1807 1.4238 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1297 -1.6689 0.2198 N 0 0 1 0 0 0 0 0 0 0 0 0 2.5099 0.9039 -0.6945 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4115 -0.9933 0.4478 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2986 -1.3829 -0.7347 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4177 -2.8388 -0.6102 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4254 -2.2826 -1.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4435 -2.0258 1.4543 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1374 0.4759 0.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0393 -2.2762 1.1835 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7171 -1.0221 0.6255 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1727 -1.2648 0.3183 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1164 2.2761 -0.9194 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7231 2.5485 -0.4309 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5532 -1.7173 -0.9451 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1393 -1.0366 1.2976 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9004 -1.9416 -1.2292 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4864 -1.2610 1.0137 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3740 2.0922 -1.1615 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5259 3.2574 0.7542 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8669 -1.7133 -0.2498 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6683 2.3448 -0.7072 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7685 3.5099 1.2084 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8656 3.0537 0.4777 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8931 -1.2937 1.3868 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7000 -0.5423 -1.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1527 -1.9657 -0.3674 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5301 -3.2164 -1.1265 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8697 -3.6551 -0.0328 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9229 -1.6959 -2.3753 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0051 -3.0694 -2.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8968 -2.9008 1.9365 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5133 -1.2025 2.1775 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5235 -2.5661 2.1249 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1722 -3.1238 0.5001 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6233 -0.1917 1.3366 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2229 -0.6930 -0.2953 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2573 0.2267 -1.4069 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1805 2.4677 -1.9965 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8387 2.9409 -0.4314 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8091 -1.8994 -1.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8549 -0.6845 2.2856 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1966 -2.2934 -2.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2391 -1.0831 1.7761 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2175 1.5384 -2.0845 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3714 3.6168 1.3346 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9158 -1.8875 -0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9221 4.0609 2.1317 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8685 3.2568 0.8444 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 2 10 2 0 0 0 0 3 5 1 0 0 0 0 3 7 1 0 0 0 0 3 9 1 0 0 0 0 4 10 1 0 0 0 0 4 14 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 26 1 0 0 0 0 6 8 1 0 0 0 0 6 27 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 11 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 16 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 20 2 0 0 0 0 15 21 1 0 0 0 0 16 18 1 0 0 0 0 16 42 1 0 0 0 0 17 19 2 0 0 0 0 17 43 1 0 0 0 0 18 22 2 0 0 0 0 18 44 1 0 0 0 0 19 22 1 0 0 0 0 19 45 1 0 0 0 0 20 23 1 0 0 0 0 20 46 1 0 0 0 0 21 24 2 0 0 0 0 21 47 1 0 0 0 0 22 48 1 0 0 0 0 23 25 2 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 50 1 0 0 0 0 M END $$$$