@MOLECULE (1r,3r,5z,6s,7r,9r)-5-(1-bromopropylidene)-9-[(1s,2z)-1-chloro-2-penten-4-yn-1-yl]-4,8-dioxatricyclo[4.2.1.0~3,7~]nonane 35 37 0 0 0 SMALL USER_CHARGES @ATOM 1 BR -2.7682 0.3339 -0.7717 Br 1 UNL111111111 -0.0519 2 CL 2.9691 -1.9515 -0.5429 Cl 1 UNL111111111 -0.1856 3 O 2.9513 2.2914 0.5081 O.3 1 UNL111111111 -0.3702 4 O -0.1412 1.6215 -0.9283 O.2 1 UNL111111111 -0.3137 5 C 0.9360 1.2137 1.1352 C.3 1 UNL111111111 -0.1944 6 C 1.5516 2.5255 0.5152 C.3 1 UNL111111111 0.0620 7 C 2.0664 0.1770 0.8071 C.3 1 UNL111111111 -0.1853 8 C 2.9696 1.0127 -0.1637 C.3 1 UNL111111111 0.1135 9 C 1.1166 2.3016 -0.9759 C.3 1 UNL111111111 0.0629 10 C 2.2198 1.3397 -1.4778 C.3 1 UNL111111111 -0.3589 11 C -0.2862 1.0143 0.2987 C.2 1 UNL111111111 0.1530 12 C 1.5625 -1.1264 0.2210 C.3 1 UNL111111111 -0.0243 13 C -1.4325 0.3867 0.5754 C.2 1 UNL111111111 -0.1370 14 C 1.0642 -2.0930 1.2309 C.2 1 UNL111111111 -0.1862 15 C -1.7712 -0.2676 1.8618 C.3 1 UNL111111111 -0.2367 16 C 0.0703 -2.9590 0.9744 C.2 1 UNL111111111 -0.0800 17 C -2.5880 0.6757 2.7495 C.3 1 UNL111111111 -0.4263 18 C -0.6208 -3.0064 -0.2491 C.1 1 UNL111111111 -0.1062 19 C -1.2194 -3.0421 -1.3026 C.1 1 UNL111111111 -0.1435 20 H 0.7349 1.2829 2.2141 H 1 UNL111111111 0.1691 21 H 1.3474 3.4767 0.9960 H 1 UNL111111111 0.1579 22 H 2.6530 -0.0166 1.7355 H 1 UNL111111111 0.1674 23 H 4.0111 0.6952 -0.2504 H 1 UNL111111111 0.1585 24 H 0.9335 3.1903 -1.5901 H 1 UNL111111111 0.1564 25 H 2.8897 1.8268 -2.2027 H 1 UNL111111111 0.1645 26 H 1.7992 0.4574 -1.9817 H 1 UNL111111111 0.1747 27 H 0.8445 -0.9655 -0.6211 H 1 UNL111111111 0.1835 28 H 1.5790 -2.0901 2.1926 H 1 UNL111111111 0.1645 29 H -2.3318 -1.2148 1.6986 H 1 UNL111111111 0.1612 30 H -0.8465 -0.5807 2.3946 H 1 UNL111111111 0.1470 31 H -0.2569 -3.6864 1.7299 H 1 UNL111111111 0.1696 32 H -2.0556 1.6161 2.9310 H 1 UNL111111111 0.1451 33 H -3.5484 0.9318 2.2844 H 1 UNL111111111 0.1547 34 H -2.8041 0.2177 3.7204 H 1 UNL111111111 0.1420 35 H -1.7315 -3.0665 -2.1964 H 1 UNL111111111 0.1929 @BOND 1 35 19 1 2 19 18 3 3 18 16 1 4 31 16 1 5 16 14 2 6 29 15 1 7 14 28 1 8 14 12 1 9 1 13 1 10 2 12 1 11 27 12 1 12 12 7 1 13 15 30 1 14 15 13 1 15 15 17 1 16 13 11 2 17 33 17 1 18 34 17 1 19 17 32 1 20 26 10 1 21 11 4 1 22 11 5 1 23 7 22 1 24 7 5 1 25 7 8 1 26 4 9 1 27 10 8 1 28 10 25 1 29 10 9 1 30 5 20 1 31 5 6 1 32 8 23 1 33 8 3 1 34 9 24 1 35 9 6 1 36 6 3 1 37 6 21 1