BE8IC3 -OEChem-04042105473D 39 42 0 0 0 0 0 0 0999 V2000 0.6545 4.3858 -0.2262 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.1016 -2.7308 0.1097 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7174 -0.9860 0.4961 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4671 -0.4184 -0.6575 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9702 -0.5304 0.3943 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4130 2.4809 0.0241 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1338 1.8454 -0.4403 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8423 0.1546 -0.1909 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7811 1.1890 0.0354 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5472 -1.4901 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4661 -0.4957 0.2802 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5318 0.5593 -0.4231 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2235 -1.2000 -0.1795 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1098 0.8398 0.2729 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8458 -0.4459 -0.3945 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5855 -0.5006 0.1284 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4791 -2.4043 0.3856 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3624 0.2578 0.6934 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6991 -1.1772 -1.2208 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7322 0.2306 0.9548 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0689 -1.2046 -0.9595 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1106 2.7387 -0.2125 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5158 0.1914 1.5267 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8648 -1.2893 -0.4567 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5245 -2.0131 -0.3419 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8596 1.6056 0.4506 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1689 -1.1377 -1.3107 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7719 -2.8839 1.3267 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1032 -2.8033 -0.4223 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7164 0.8232 1.3599 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3093 -1.7295 -2.0723 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0845 0.7917 1.8147 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6905 -1.7881 -1.6313 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3284 1.2673 1.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0983 -0.1779 2.4701 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6024 0.0701 1.5987 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8414 -0.9176 -1.4872 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6130 -2.3556 -0.4448 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9053 -1.2115 -0.1219 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 2 10 1 0 0 0 0 2 17 1 0 0 0 0 3 11 1 0 0 0 0 3 17 1 0 0 0 0 4 12 1 0 0 0 0 4 15 1 0 0 0 0 4 27 1 0 0 0 0 5 16 1 0 0 0 0 5 23 1 0 0 0 0 5 24 1 0 0 0 0 6 9 1 0 0 0 0 6 22 2 0 0 0 0 7 12 2 0 0 0 0 7 22 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 8 13 2 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 14 1 0 0 0 0 13 25 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 20 2 0 0 0 0 16 21 1 0 0 0 0 17 28 1 0 0 0 0 17 29 1 0 0 0 0 18 20 1 0 0 0 0 18 30 1 0 0 0 0 19 21 2 0 0 0 0 19 31 1 0 0 0 0 20 32 1 0 0 0 0 21 33 1 0 0 0 0 23 34 1 0 0 0 0 23 35 1 0 0 0 0 23 36 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 M END $$$$