BD1WM4 -OEChem-04022117423D 36 37 0 0 0 0 0 0 0999 V2000 -0.2868 -3.1276 -0.3713 S 0 0 0 0 0 0 0 0 0 0 0 0 0.2213 -4.3738 0.1900 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6968 -3.1033 -1.7701 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3764 2.6386 -1.2060 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8231 3.0802 -1.1426 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.3328 3.5011 0.9555 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5879 -2.5861 0.6200 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8364 1.0501 0.4743 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3842 2.7186 -0.0241 N 0 3 0 0 0 0 0 0 0 0 0 0 0.9271 -1.8980 -0.1228 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0462 -1.2329 0.4556 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9657 -0.7778 -0.9531 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8584 -2.0356 0.9063 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8669 0.0671 0.2751 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9357 0.2047 -0.7543 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8283 -1.0531 1.1054 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5354 -0.8182 -0.7772 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9950 -0.3548 1.5315 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9319 1.3823 0.1383 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9798 0.4943 -0.9365 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4395 0.9577 1.3723 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0302 2.2340 -0.2501 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1928 3.0325 0.2836 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5844 -2.9245 1.5913 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2580 -0.6526 -1.7672 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8427 -2.8954 1.5701 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9036 1.0413 -1.4381 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5466 -1.1723 1.9126 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6117 -1.4968 -1.6204 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6110 -0.6760 2.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3628 0.7885 -1.9103 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3864 1.6217 2.2313 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4787 0.8766 1.2448 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9955 3.3252 1.3187 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3323 3.9333 -0.3204 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1062 2.4324 0.2409 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 7 1 0 0 0 0 1 10 1 0 0 0 0 4 22 2 0 0 0 0 5 9 1 0 0 0 0 6 9 2 0 0 0 0 7 11 1 0 0 0 0 7 24 1 0 0 0 0 8 14 1 0 0 0 0 8 22 1 0 0 0 0 8 33 1 0 0 0 0 9 19 1 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 11 17 2 0 0 0 0 11 18 1 0 0 0 0 12 15 1 0 0 0 0 12 25 1 0 0 0 0 13 16 2 0 0 0 0 13 26 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 15 27 1 0 0 0 0 16 28 1 0 0 0 0 17 20 1 0 0 0 0 17 29 1 0 0 0 0 18 21 2 0 0 0 0 18 30 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 20 31 1 0 0 0 0 21 32 1 0 0 0 0 22 23 1 0 0 0 0 23 34 1 0 0 0 0 23 35 1 0 0 0 0 23 36 1 0 0 0 0 M CHG 2 5 -1 9 1 M END $$$$