BDN3B2 -OEChem-04022116403D 42 44 0 0 0 0 0 0 0999 V2000 3.1441 2.3159 -0.7629 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4156 1.8538 0.6466 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2861 -0.3443 2.3646 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5010 0.8307 0.0119 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8370 -0.9380 -1.0778 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3175 1.6058 -0.0597 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0681 1.8169 0.2577 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8316 0.1888 -0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9030 1.0533 0.3283 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8094 1.2020 -0.3281 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3731 2.9221 -0.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7909 -1.7560 0.2819 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0127 3.1332 -0.2008 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9914 0.1972 -0.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6517 -0.7918 0.8565 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7921 3.6856 -0.5887 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9711 -0.7752 -0.6936 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6312 -1.7643 1.0569 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3410 1.2416 0.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8389 -2.7956 0.4958 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4355 -0.1795 1.1626 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6960 -1.2907 0.2196 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7821 -2.5936 0.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0283 -3.5994 -0.2451 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1790 -3.2760 -1.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0754 -1.9424 -1.9507 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9216 0.0265 0.6839 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3373 -0.1240 0.3194 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2783 3.4195 -0.8356 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9083 3.7456 -0.2642 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1491 0.9495 -1.6625 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7850 -0.8165 1.5104 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7501 4.7107 -0.9457 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8707 -0.7580 -1.3031 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4847 -2.5174 1.8267 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3701 -3.0187 -0.4357 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3979 -3.7352 0.8457 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5641 -2.4503 1.2393 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6638 -2.8430 1.7319 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1027 -4.6333 0.0782 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3714 -4.0435 -2.3299 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1850 -1.6376 -2.9862 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 2 0 0 0 0 2 19 2 0 0 0 0 3 21 2 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 4 28 1 0 0 0 0 5 22 1 0 0 0 0 5 26 2 0 0 0 0 6 9 1 0 0 0 0 6 11 2 0 0 0 0 7 9 2 0 0 0 0 7 13 1 0 0 0 0 7 19 1 0 0 0 0 8 10 1 0 0 0 0 8 14 2 0 0 0 0 8 15 1 0 0 0 0 9 27 1 0 0 0 0 11 16 1 0 0 0 0 11 29 1 0 0 0 0 12 17 2 0 0 0 0 12 18 1 0 0 0 0 12 20 1 0 0 0 0 13 16 2 0 0 0 0 13 30 1 0 0 0 0 14 17 1 0 0 0 0 14 31 1 0 0 0 0 15 18 2 0 0 0 0 15 32 1 0 0 0 0 16 33 1 0 0 0 0 17 34 1 0 0 0 0 18 35 1 0 0 0 0 19 21 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 25 2 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 26 42 1 0 0 0 0 M END $$$$