BQX29W -OEChem-04022105043D 49 53 0 1 0 0 0 0 0999 V2000 1.8475 -1.6797 -0.7424 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9938 0.1496 2.2050 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2876 1.9201 -0.7711 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.7431 3.4800 -0.8020 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2588 -1.4967 1.1383 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1238 2.3175 -0.5222 N 0 3 0 0 0 0 0 0 0 0 0 0 2.1138 -1.2397 0.5789 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1403 -0.1608 0.4542 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9008 -0.7573 1.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3005 -2.4487 0.0803 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4433 -1.2760 1.9598 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7632 -2.5073 -0.8255 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8751 1.0458 -0.2138 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8904 2.0283 -0.2971 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3885 -0.3950 1.0318 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4110 -0.3311 1.3077 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3938 -3.3050 -0.1196 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7337 -3.3816 -1.9156 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6245 1.2989 -0.8008 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1409 1.7755 0.2899 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3868 0.5711 0.9498 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4157 -4.1939 -1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6250 3.2350 -0.9649 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3538 -4.2308 -2.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7099 -0.7510 1.0212 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0109 0.9663 0.9878 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3784 2.5034 -1.4604 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3768 3.4695 -1.5422 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6088 0.1264 0.4147 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9098 1.8437 0.3813 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2087 1.4238 0.0948 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5237 -2.0939 1.1375 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8994 -2.2269 2.2542 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1353 -0.8206 2.9107 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6025 -1.3256 1.5508 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2523 -3.3252 0.5416 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5574 -3.4059 -2.6242 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8041 0.5910 -0.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9360 2.5164 0.2382 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3583 0.3882 1.3996 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2670 -4.8541 -1.3377 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3905 4.0045 -1.0412 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3759 -4.9162 -2.9388 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0386 -1.7564 1.2695 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0130 1.3261 1.2117 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4075 2.6864 -1.9119 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1846 4.4069 -2.0561 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6128 -0.2348 0.2074 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5640 2.8477 0.1488 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 12 1 0 0 0 0 2 9 2 0 0 0 0 3 6 1 0 0 0 0 4 6 2 0 0 0 0 5 9 1 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 32 1 0 0 0 0 8 13 1 0 0 0 0 8 15 2 0 0 0 0 10 12 1 0 0 0 0 10 17 2 0 0 0 0 11 16 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 18 2 0 0 0 0 13 14 1 0 0 0 0 13 19 2 0 0 0 0 14 20 1 0 0 0 0 14 23 2 0 0 0 0 15 21 1 0 0 0 0 15 35 1 0 0 0 0 16 25 2 0 0 0 0 16 26 1 0 0 0 0 17 22 1 0 0 0 0 17 36 1 0 0 0 0 18 24 1 0 0 0 0 18 37 1 0 0 0 0 19 27 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 22 24 2 0 0 0 0 22 41 1 0 0 0 0 23 28 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 25 29 1 0 0 0 0 25 44 1 0 0 0 0 26 30 2 0 0 0 0 26 45 1 0 0 0 0 27 28 2 0 0 0 0 27 46 1 0 0 0 0 28 47 1 0 0 0 0 29 31 2 0 0 0 0 29 48 1 0 0 0 0 30 31 1 0 0 0 0 30 49 1 0 0 0 0 M CHG 2 3 -1 6 1 M END $$$$