BUE13A -OEChem-04042104203D 47 48 0 0 0 0 0 0 0999 V2000 5.4603 1.4056 -0.0158 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.5290 0.7502 -0.9993 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3495 -1.9501 -0.4037 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3467 0.4873 -0.7136 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3343 2.7813 -0.4695 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1348 -1.8555 -1.3797 O 0 5 0 0 0 0 0 0 0 0 0 0 5.2743 -2.0437 0.8030 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5101 -0.2423 -0.3014 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0656 -0.1262 0.8407 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7401 -1.5664 -0.2256 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.3621 0.2051 -0.0169 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5042 -0.3156 1.1463 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5023 1.0395 -0.9784 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2768 -1.0697 0.6376 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2768 0.2568 -1.4441 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5440 1.0203 0.5021 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1511 0.0510 -0.1954 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4237 -0.5347 0.9885 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1155 -0.8763 0.1447 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2636 -0.3258 0.1038 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8529 0.7098 0.0275 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6486 -0.6660 -0.0781 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3540 -1.1838 -0.0398 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4680 1.0500 0.2096 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7625 1.5679 0.1713 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9704 1.4312 1.6863 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7605 -0.6576 -0.5674 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0996 -0.9764 1.7871 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1758 0.5275 1.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1732 1.9582 -0.4755 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0955 1.3426 -1.8489 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6720 -1.3872 1.4888 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5804 -1.9751 0.0987 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5800 -0.6123 -2.0399 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6554 0.8909 -2.0842 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2074 1.8988 1.0629 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1710 0.4152 1.1653 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1697 1.3672 -0.3269 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4929 -1.6257 0.9833 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8116 -0.1164 1.9207 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7932 0.7271 1.3166 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1995 -2.2581 -0.1178 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6458 1.7543 0.2935 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8936 2.6428 0.2579 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9719 1.8646 1.7323 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2734 2.0484 2.2564 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9902 0.4115 2.0734 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 21 1 0 0 0 0 1 26 1 0 0 0 0 2 17 2 0 0 0 0 3 19 2 0 0 0 0 6 10 1 0 0 0 0 7 10 2 0 0 0 0 8 14 1 0 0 0 0 8 15 1 0 0 0 0 8 17 1 0 0 0 0 9 18 1 0 0 0 0 9 19 1 0 0 0 0 9 41 1 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 11 27 1 0 0 0 0 12 14 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 15 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 20 23 2 0 0 0 0 20 24 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 M CHG 2 6 -1 10 1 M END $$$$