B2SEM0 -OEChem-04012115233D 48 49 0 1 0 0 0 0 0999 V2000 3.6721 0.1127 0.7598 P 0 0 2 0 0 0 0 0 0 0 0 0 3.3783 2.6133 -0.7615 P 0 0 0 0 0 0 0 0 0 0 0 0 0.0442 -2.2112 1.0339 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8909 -3.2929 -1.7846 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0149 -4.7918 -0.4915 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6199 -1.1061 0.9235 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9460 -1.9130 0.3082 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2187 0.2122 0.4782 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8820 1.2162 -0.1185 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7858 -0.4516 -0.2689 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2311 0.6386 2.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0178 3.2581 -1.3492 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6974 3.5216 0.5367 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5041 2.4850 -1.7448 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8167 -0.9498 0.3932 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7976 0.3614 0.4782 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8409 -2.6140 -1.1270 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3773 -3.4916 -0.9310 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.1922 -2.2388 0.3024 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0864 -2.7996 0.2251 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0241 -1.6866 -0.2234 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2395 -0.9051 0.3878 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0108 0.2060 0.4776 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0715 1.5210 0.5666 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7346 1.4965 0.5697 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8598 2.7902 0.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1504 3.3721 -0.7241 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9733 4.6471 -0.6224 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5714 -1.7326 -1.7214 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9844 -3.6135 -1.8318 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8377 -2.9941 0.7658 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6242 -3.5055 0.8683 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8237 -2.1319 -0.8268 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5487 -0.9337 -0.8537 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6584 -2.6964 -1.8027 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4617 -4.7148 0.3679 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8110 0.4353 0.4758 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1418 2.4021 0.6362 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7965 2.6171 1.2017 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3045 3.5286 1.2498 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2128 3.5926 -1.2487 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6973 2.6437 -1.3351 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1717 5.0504 -1.6204 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4425 5.4121 -0.0466 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9353 4.4559 -0.1364 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4884 -1.0453 0.0717 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0710 4.0896 -1.8668 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1028 4.4056 0.4098 H 0 0 0 0 0 0 0 0 0 0 0 0 1 6 1 0 0 0 0 1 9 1 0 0 0 0 1 10 1 0 0 0 0 1 11 2 0 0 0 0 2 9 1 0 0 0 0 2 12 1 0 0 0 0 2 13 1 0 0 0 0 2 14 2 0 0 0 0 3 19 1 0 0 0 0 3 20 1 0 0 0 0 4 17 1 0 0 0 0 4 35 1 0 0 0 0 5 18 1 0 0 0 0 5 36 1 0 0 0 0 6 21 1 0 0 0 0 7 22 2 0 0 0 0 8 23 2 0 0 0 0 10 46 1 0 0 0 0 12 47 1 0 0 0 0 13 48 1 0 0 0 0 15 19 1 0 0 0 0 15 22 1 0 0 0 0 15 23 1 0 0 0 0 16 22 1 0 0 0 0 16 24 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 29 1 0 0 0 0 18 20 1 0 0 0 0 18 30 1 0 0 0 0 19 31 1 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 21 33 1 0 0 0 0 21 34 1 0 0 0 0 23 25 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 25 38 1 0 0 0 0 26 27 1 0 0 0 0 26 39 1 0 0 0 0 26 40 1 0 0 0 0 27 28 1 0 0 0 0 27 41 1 0 0 0 0 27 42 1 0 0 0 0 28 43 1 0 0 0 0 28 44 1 0 0 0 0 28 45 1 0 0 0 0 M END $$$$