BHU3M1 -OEChem-04012112583D 27 28 0 0 0 0 0 0 0999 V2000 -4.9559 1.3548 -0.4844 F 0 0 0 0 0 0 0 0 0 0 0 0 -5.2562 -0.7795 -0.7262 F 0 0 0 0 0 0 0 0 0 0 0 0 -5.0869 0.0728 1.2672 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0716 -0.6426 -0.0703 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3071 1.9364 0.2238 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0242 1.5388 0.1773 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5287 1.1671 0.1387 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3844 -2.6354 -0.2917 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3252 -0.4483 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1598 0.2457 0.0315 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0881 -0.0639 -0.0133 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8700 0.7453 -0.5248 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1620 -1.4498 0.4416 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4572 -0.2291 -0.0206 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2514 0.9375 -0.5059 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5435 -1.2575 0.4604 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2049 0.9158 0.1093 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5649 0.1420 0.0079 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9663 -1.5503 -0.1696 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2963 -1.6367 -0.0613 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2542 1.5344 -0.9442 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7507 -2.3842 0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6577 1.8711 -0.8853 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1875 -2.0432 0.8465 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5003 2.9239 0.3353 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9028 2.1052 0.2447 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2189 0.4273 0.0555 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 2 18 1 0 0 0 0 3 18 1 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 17 1 0 0 0 0 5 25 1 0 0 0 0 6 10 2 0 0 0 0 7 17 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 19 3 0 0 0 0 9 12 2 0 0 0 0 9 13 1 0 0 0 0 10 14 1 0 0 0 0 11 15 2 0 0 0 0 11 16 1 0 0 0 0 11 18 1 0 0 0 0 12 15 1 0 0 0 0 12 21 1 0 0 0 0 13 16 2 0 0 0 0 13 22 1 0 0 0 0 14 17 2 0 0 0 0 14 19 1 0 0 0 0 15 23 1 0 0 0 0 16 24 1 0 0 0 0 M END $$$$