BVN53S -OEChem-04022104543D 40 40 0 1 0 0 0 0 0999 V2000 -1.3559 1.4190 -1.2146 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1329 -0.2472 -1.1337 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5827 2.3973 0.9613 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8380 0.5763 0.4939 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9520 -2.1619 0.2171 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1902 -1.9058 0.5590 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6189 -0.1219 0.1542 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8940 0.2027 0.4440 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2176 -1.8849 -0.1716 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6011 1.3447 0.0005 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4619 0.1916 0.5229 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1610 0.8886 -0.2637 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2986 -1.0402 -0.3666 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8267 -1.3789 -0.6040 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3380 1.9894 -0.9277 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0067 1.6636 0.4545 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0119 -2.6216 0.2229 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4793 1.2908 0.5174 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8226 -0.6016 0.1343 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0469 1.7483 -0.9168 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2275 -0.0422 1.5676 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6958 0.6203 0.6932 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7855 -0.8427 -1.3305 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8045 -2.1560 -1.3793 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7589 2.2253 -1.9114 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3284 2.9126 -0.3402 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1912 2.0498 1.7808 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0697 0.8067 -0.4219 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8339 -2.9169 -0.3843 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4459 1.0444 1.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8850 2.7131 0.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4514 -2.9715 1.1496 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7033 -1.9774 -0.2973 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2518 -3.4945 -0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8263 1.4618 1.5441 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0425 1.9406 -0.1649 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8198 1.1777 0.7068 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8360 -0.1743 0.4256 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5386 -2.5957 -0.4212 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1943 -2.1572 -0.1567 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 12 1 0 0 0 0 2 14 1 0 0 0 0 3 10 1 0 0 0 0 3 27 1 0 0 0 0 4 11 1 0 0 0 0 4 28 1 0 0 0 0 5 13 1 0 0 0 0 5 29 1 0 0 0 0 6 14 1 0 0 0 0 6 17 1 0 0 0 0 7 18 1 0 0 0 0 7 19 2 0 0 0 0 8 19 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 19 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 20 1 0 0 0 0 11 13 1 0 0 0 0 11 21 1 0 0 0 0 12 15 1 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 13 23 1 0 0 0 0 14 24 1 0 0 0 0 15 25 1 0 0 0 0 15 26 1 0 0 0 0 16 18 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 M END $$$$