B6MC7D -OEChem-04012112493D 43 45 0 0 0 0 0 0 0999 V2000 -10.2244 -0.1941 1.2088 Br 0 0 0 0 0 0 0 0 0 0 0 0 -3.4876 -2.7248 -0.5269 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.6831 1.2768 -0.5447 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3352 -0.4213 -0.6726 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1524 2.9377 -0.4259 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5565 -1.3540 0.0227 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3491 0.6519 -0.0724 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6514 0.7106 0.1085 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6479 -0.6509 -0.3846 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3369 0.7167 -0.3612 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0266 0.2209 -0.1764 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0067 1.1503 -0.2578 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5892 -1.5709 -0.3012 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0556 -1.0504 -0.4942 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7356 -1.1382 -0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9973 -0.0983 -0.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4048 1.7398 -0.4453 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0647 0.1046 0.4188 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5320 -0.2837 0.2953 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3509 0.2809 1.4405 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5285 -0.1274 0.0203 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0116 0.3357 0.2155 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9821 1.3210 0.2916 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3442 -1.0086 0.2411 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3231 0.9516 0.3966 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6852 -1.3780 0.3459 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6746 -0.3979 0.4237 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2282 2.2124 -0.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7662 -2.6433 -0.3141 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4764 -1.9230 -0.1392 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9906 1.1996 0.4356 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6614 -0.2870 1.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6167 -1.3775 0.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9181 0.0706 -0.6693 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4808 1.6603 -0.0624 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0406 -0.1269 2.4064 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3101 1.3731 1.4746 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4747 1.7119 0.0946 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7192 2.3749 0.2712 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6416 -1.8263 0.1857 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0936 1.7147 0.4571 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9606 -2.4285 0.3671 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7187 -0.6856 0.5053 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 2 14 1 0 0 0 0 3 16 1 0 0 0 0 3 17 1 0 0 0 0 4 16 1 0 0 0 0 4 18 1 0 0 0 0 5 17 2 0 0 0 0 6 21 2 0 0 0 0 7 11 1 0 0 0 0 7 21 1 0 0 0 0 7 35 1 0 0 0 0 8 21 1 0 0 0 0 8 22 1 0 0 0 0 8 38 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 9 14 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 28 1 0 0 0 0 13 15 2 0 0 0 0 13 29 1 0 0 0 0 14 16 2 0 0 0 0 15 30 1 0 0 0 0 18 19 1 0 0 0 0 18 31 1 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 23 25 1 0 0 0 0 23 39 1 0 0 0 0 24 26 2 0 0 0 0 24 40 1 0 0 0 0 25 27 2 0 0 0 0 25 41 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 27 43 1 0 0 0 0 M END $$$$