BO5HB9 -OEChem-04022115093D 33 36 0 0 0 0 0 0 0999 V2000 -2.4420 1.2194 1.3058 S 0 0 0 0 0 0 0 0 0 0 0 0 1.7013 -1.2556 -1.4773 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.1108 -2.2043 0.5130 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.7073 1.9806 -0.6341 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9123 2.2981 2.1189 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8654 0.9416 1.3166 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5526 -0.1976 1.6556 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2397 -0.6439 0.9854 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6410 -1.7927 -0.0625 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6621 -1.3178 0.7309 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7206 -1.2145 -0.0765 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9505 -0.4381 -0.6147 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5188 -0.1934 0.6924 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0536 -2.8991 -0.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9709 1.5579 -0.3665 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3741 -3.2274 -0.6457 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2211 -0.0419 -1.0623 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3915 0.4714 1.5809 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7046 1.4634 -1.5262 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0651 0.6144 -0.1629 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6577 0.8687 1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8361 1.8529 -2.5736 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6335 2.1579 -1.9793 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5864 -0.0293 1.9657 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4287 -3.4447 -1.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9411 -4.0202 -1.1128 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5458 -0.2370 -2.0797 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0831 0.6754 2.6024 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7357 1.1517 -1.6119 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0527 0.9296 -0.4892 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3277 1.3804 1.8274 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0582 1.9039 -3.6296 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3217 2.4954 -2.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 2 0 0 0 0 1 6 2 0 0 0 0 1 7 1 0 0 0 0 1 15 1 0 0 0 0 2 11 1 0 0 0 0 2 12 1 0 0 0 0 3 10 1 0 0 0 0 3 16 1 0 0 0 0 4 15 1 0 0 0 0 4 23 1 0 0 0 0 7 10 1 0 0 0 0 7 24 1 0 0 0 0 8 11 2 0 0 0 0 8 13 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 18 2 0 0 0 0 14 16 2 0 0 0 0 14 25 1 0 0 0 0 15 19 2 0 0 0 0 16 26 1 0 0 0 0 17 20 1 0 0 0 0 17 27 1 0 0 0 0 18 21 1 0 0 0 0 18 28 1 0 0 0 0 19 22 1 0 0 0 0 19 29 1 0 0 0 0 20 21 2 0 0 0 0 20 30 1 0 0 0 0 21 31 1 0 0 0 0 22 23 2 0 0 0 0 22 32 1 0 0 0 0 23 33 1 0 0 0 0 M END $$$$