B1YCQ6 -OEChem-04012113463D 59 61 0 1 0 0 0 0 0999 V2000 0.4233 2.8987 -0.4562 S 0 0 0 0 0 0 0 0 0 0 0 0 4.0224 -2.6886 -1.0120 F 0 0 0 0 0 0 0 0 0 0 0 0 3.8566 -2.5755 1.1562 F 0 0 0 0 0 0 0 0 0 0 0 0 5.7475 -3.1553 0.2338 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.6062 -1.0780 -2.1383 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6359 4.0121 0.4399 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1719 3.1044 -1.8642 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0239 -0.7436 -1.0469 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2103 0.3077 0.5020 N 0 0 1 0 0 0 0 0 0 0 0 0 -0.8221 1.9014 0.1856 N 0 0 1 0 0 0 0 0 0 0 0 0 -6.2003 0.0095 -0.9076 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7510 -1.5931 0.2661 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9538 -2.9044 0.1055 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8516 -2.4350 0.9446 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3076 -3.6432 0.1541 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0860 -0.6151 1.2234 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0245 1.5483 1.2668 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1558 -0.8800 -1.0506 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9123 -0.3201 0.2302 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1434 2.5536 0.5015 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.0199 0.6242 -0.5682 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9592 3.8068 1.3562 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7971 1.8032 -0.2988 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2992 1.4921 0.9648 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3804 1.2474 -1.4375 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9681 0.0692 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3847 0.6251 1.0897 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4659 0.3805 -1.3125 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1294 -0.8569 0.0848 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6819 -2.3317 0.1144 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0156 -0.5640 1.3222 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2931 -3.1606 0.9428 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3988 -3.0458 -0.8262 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7466 -2.5428 2.0313 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8901 -2.1728 0.7244 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5648 -1.1202 2.0479 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8897 -0.0381 1.7027 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7759 -3.7805 -0.8273 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3091 -4.5983 0.6853 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0014 2.0155 1.4453 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5813 1.3293 2.2483 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4093 -0.6039 1.1644 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0306 -1.2260 -0.3693 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6378 2.8265 -0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0737 0.1068 -0.7365 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4693 0.8395 -1.5455 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9173 4.1211 1.7867 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6160 4.6554 0.7576 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2652 3.6391 2.1867 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6528 0.1768 -0.0149 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5511 0.5337 -1.7022 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8504 1.9117 1.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0062 1.4691 -2.4326 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7309 0.3952 2.0917 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8958 -0.0484 -2.2136 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3156 0.4905 1.3513 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5206 -0.8160 2.2654 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9451 -1.1443 1.2739 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2806 0.1911 -1.1304 H 0 0 0 0 0 0 0 0 0 0 0 0 1 6 2 0 0 0 0 1 7 2 0 0 0 0 1 10 1 0 0 0 0 1 23 1 0 0 0 0 2 30 1 0 0 0 0 3 30 1 0 0 0 0 4 30 1 0 0 0 0 5 18 2 0 0 0 0 8 29 1 0 0 0 0 8 59 1 0 0 0 0 9 16 1 0 0 0 0 9 17 1 0 0 0 0 9 19 1 0 0 0 0 10 20 1 0 0 0 0 10 21 1 0 0 0 0 11 18 1 0 0 0 0 11 50 1 0 0 0 0 11 51 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 12 18 1 0 0 0 0 13 15 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 20 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 19 21 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 22 1 0 0 0 0 20 44 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 24 27 1 0 0 0 0 24 52 1 0 0 0 0 25 28 2 0 0 0 0 25 53 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 26 29 1 0 0 0 0 27 54 1 0 0 0 0 28 55 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 M END $$$$