BXDT49 -OEChem-04022110443D 45 47 0 1 0 0 0 0 0999 V2000 3.5262 1.4381 1.2662 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9013 -0.4411 -0.5924 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7164 -1.4423 -0.4449 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4390 0.3646 0.8204 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.3797 1.5696 -0.4758 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7463 1.7181 0.5722 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0476 -0.1409 -0.5301 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2409 1.1014 -1.8143 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0363 -0.2004 -1.6833 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3886 -0.5871 1.4507 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3975 0.5230 -0.0101 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5713 0.5816 1.8505 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0062 -0.5057 0.8732 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0112 2.9644 -0.6713 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7158 0.5147 -0.5022 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9402 -1.4782 1.2712 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7686 -1.5398 -1.4543 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7465 -2.5233 -0.6076 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6309 -0.4612 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2448 -1.4553 0.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4730 2.4640 0.2226 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3361 2.1095 1.5144 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7895 0.6132 -0.8305 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9155 1.8809 -2.1941 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5360 0.9709 -2.5791 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2840 -0.9884 -1.5918 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5389 -0.3711 -2.6429 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2477 -0.2473 2.4903 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7508 -1.6074 1.5852 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0569 -0.3632 2.1168 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1967 1.0482 2.7683 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5491 3.2868 0.2278 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7149 2.9869 -1.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2440 3.7173 -0.8875 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0381 1.2685 -1.2154 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6485 -2.2638 1.9644 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2990 -2.4933 -1.3466 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5213 -0.7567 -1.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4042 -1.4803 -2.4848 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1959 -3.4343 -0.1913 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5496 -2.7570 -1.6632 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7812 -2.4417 -0.1186 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2355 1.5676 1.9185 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9512 -2.2175 1.1022 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9968 0.3156 -1.1959 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 43 1 0 0 0 0 2 19 1 0 0 0 0 2 45 1 0 0 0 0 3 7 1 0 0 0 0 3 17 1 0 0 0 0 3 18 1 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 4 10 1 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 11 1 0 0 0 0 5 14 1 0 0 0 0 6 21 1 0 0 0 0 6 22 1 0 0 0 0 7 9 1 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 24 1 0 0 0 0 8 25 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 13 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 13 2 0 0 0 0 11 15 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 16 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 19 2 0 0 0 0 15 35 1 0 0 0 0 16 20 2 0 0 0 0 16 36 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 20 44 1 0 0 0 0 M END $$$$