BP4QV1 -OEChem-04012112543D 43 45 0 0 0 0 0 0 0999 V2000 -3.3666 3.4615 0.8117 S 0 0 0 0 0 0 0 0 0 0 0 0 5.0511 -0.8208 1.2517 F 0 0 0 0 0 0 0 0 0 0 0 0 6.9805 -0.2506 0.3986 F 0 0 0 0 0 0 0 0 0 0 0 0 5.7440 -1.7197 -0.6446 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.6841 1.1655 -0.1668 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1081 0.4772 -0.6303 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6765 -0.8891 -0.7213 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4478 1.0009 -0.0359 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2889 0.3860 -0.3699 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8810 2.4856 0.4287 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0257 1.0988 -0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3857 1.3140 -0.0544 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9190 -1.9486 -0.0995 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7081 0.4321 -0.2607 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1752 2.2719 0.4134 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6720 -1.2687 -1.7216 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4987 -0.1188 -0.6919 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9256 2.1073 0.1444 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6892 -1.9108 1.2679 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4339 -2.9879 -0.8795 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7696 0.6807 -0.4891 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8703 -0.3277 -0.8354 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2972 1.8982 0.0008 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9579 -2.9355 1.8689 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7027 -4.0126 -0.2787 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4646 -3.9862 1.0955 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5249 4.9883 0.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7073 -0.5909 0.0947 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3359 -0.4304 -1.9539 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2773 -2.0983 -1.3432 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1656 -1.5600 -2.6462 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8282 -0.9273 -0.9728 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5888 3.0668 0.5287 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0771 -1.1121 1.8937 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5910 -3.0256 -1.9529 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2246 -1.2783 -1.2247 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9932 2.6873 0.2722 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7752 -2.9170 2.9393 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3153 -4.8291 -0.8811 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8950 -4.7839 1.5632 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2517 4.9404 -0.7527 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6263 5.1482 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1992 5.8357 0.4541 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 27 1 0 0 0 0 2 28 1 0 0 0 0 3 28 1 0 0 0 0 4 28 1 0 0 0 0 5 14 2 0 0 0 0 6 21 1 0 0 0 0 6 28 1 0 0 0 0 7 13 1 0 0 0 0 7 14 1 0 0 0 0 7 16 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 8 15 1 0 0 0 0 9 12 2 0 0 0 0 10 12 1 0 0 0 0 10 15 2 0 0 0 0 11 12 1 0 0 0 0 11 17 2 0 0 0 0 11 18 1 0 0 0 0 13 19 2 0 0 0 0 13 20 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 17 22 1 0 0 0 0 17 32 1 0 0 0 0 18 23 2 0 0 0 0 18 33 1 0 0 0 0 19 24 1 0 0 0 0 19 34 1 0 0 0 0 20 25 2 0 0 0 0 20 35 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 22 36 1 0 0 0 0 23 37 1 0 0 0 0 24 26 2 0 0 0 0 24 38 1 0 0 0 0 25 26 1 0 0 0 0 25 39 1 0 0 0 0 26 40 1 0 0 0 0 27 41 1 0 0 0 0 27 42 1 0 0 0 0 27 43 1 0 0 0 0 M END $$$$