BG3R0B -OEChem-04022115283D 51 54 0 1 0 0 0 0 0999 V2000 -2.9925 1.9951 -1.2454 S 0 0 0 0 0 0 0 0 0 0 0 0 4.2798 2.0604 0.2714 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8006 2.4301 -2.3694 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4120 0.6670 -1.2255 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4392 -1.1780 -0.5435 N 0 0 2 0 0 0 0 0 0 0 0 0 4.4060 -0.2049 -0.3316 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7954 3.1949 -0.9390 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7070 -2.4469 1.9565 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5379 -3.6072 -0.4274 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2068 -0.6145 -0.2502 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3061 0.6858 0.0965 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7775 0.9717 0.0423 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2767 1.6477 0.4827 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9680 -1.3960 -0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8043 -2.5775 -0.5201 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2444 1.9582 -0.4025 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7979 -0.4090 -0.6389 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7382 2.8770 -0.0336 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3267 2.2563 1.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1988 -1.5626 0.8522 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5532 -1.9750 -1.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9823 -2.3007 0.8336 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6884 3.4855 1.2207 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3442 3.1753 2.1059 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6271 -2.7156 -1.5176 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4030 -2.8881 -0.3736 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9967 2.1738 0.2119 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1608 1.2084 0.2051 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8390 -3.1698 1.8819 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2485 -3.7416 0.7068 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0908 -2.8803 0.4927 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9842 -3.2241 -0.8453 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6431 -2.7796 -1.1941 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2127 1.5006 -1.3893 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8971 -0.6979 -1.6889 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3538 0.5174 -0.4708 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2029 -1.1912 0.0085 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1220 2.0233 2.4408 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5229 -1.1180 1.7926 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 -1.8591 -2.4026 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1545 4.1541 -0.8404 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4493 4.2017 1.5197 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3823 3.6482 3.0828 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9415 -3.1633 -2.4583 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3570 3.2062 0.2453 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3651 1.9807 1.0833 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8066 1.3725 -0.6634 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8142 0.1704 0.1716 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7659 1.3355 1.1079 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4033 -3.2715 2.8001 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1577 -4.3249 0.6355 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 7 1 0 0 0 0 1 27 1 0 0 0 0 2 12 2 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 15 1 0 0 0 0 6 12 1 0 0 0 0 6 17 1 0 0 0 0 7 18 1 0 0 0 0 7 41 1 0 0 0 0 8 22 2 0 0 0 0 8 29 1 0 0 0 0 9 26 2 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 16 2 0 0 0 0 13 19 1 0 0 0 0 14 20 2 0 0 0 0 14 21 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 16 18 1 0 0 0 0 16 34 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 23 2 0 0 0 0 19 24 2 0 0 0 0 19 38 1 0 0 0 0 20 22 1 0 0 0 0 20 39 1 0 0 0 0 21 25 2 0 0 0 0 21 40 1 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 29 30 2 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 M END $$$$