L2BR4F -OEChem-05022322513D 46 49 0 0 0 0 0 0 0999 V2000 2.1587 -3.9056 -0.2187 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9352 4.5240 0.5185 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7016 -0.0832 -0.0960 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9651 -2.5166 -0.4577 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2258 0.8784 -0.5234 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6603 -0.1435 1.4931 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0548 1.8116 -0.1843 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9673 2.6531 -0.6837 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2781 2.5360 0.1608 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7250 3.7965 0.2946 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9353 3.6850 1.1017 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9943 0.4492 -0.2077 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5406 -1.4281 -0.1087 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0949 -0.3243 -0.3288 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6133 -2.2734 -0.2284 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3084 -2.1191 -0.0057 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9682 -1.8104 -0.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0106 -1.5625 0.1314 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4992 -3.4860 -0.0517 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7842 -1.8712 1.2504 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5169 -0.7152 -0.8543 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0640 -1.3329 1.3836 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7968 -0.1769 -0.7211 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5703 -0.4858 0.3978 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9049 0.0751 0.5367 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5194 1.4916 -0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6864 2.3342 -1.7485 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0327 2.1018 -0.8329 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2664 3.0576 -1.6585 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7287 2.9245 -0.7603 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0215 1.9115 0.6671 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3396 3.4289 1.2532 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9873 4.4922 -0.1174 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8231 4.2987 1.2838 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5785 3.3171 2.0713 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0993 0.0662 -0.4414 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2433 -4.2713 -0.0002 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4065 -2.5252 2.0331 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9296 -0.4653 -1.7349 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6497 -1.5853 2.2637 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1497 0.4772 -1.5134 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2901 0.7135 -0.4732 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6073 2.1237 0.3885 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9099 3.1045 -1.7995 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5816 1.7174 -2.6472 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6667 2.8187 -1.7647 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 19 1 0 0 0 0 2 10 1 0 0 0 0 2 11 1 0 0 0 0 3 12 1 0 0 0 0 3 13 1 0 0 0 0 4 17 2 0 0 0 0 5 25 1 0 0 0 0 5 26 1 0 0 0 0 6 25 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 8 10 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 11 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 14 17 1 0 0 0 0 14 36 1 0 0 0 0 15 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 19 37 1 0 0 0 0 20 22 1 0 0 0 0 20 38 1 0 0 0 0 21 23 2 0 0 0 0 21 39 1 0 0 0 0 22 24 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 M END $$$$