BW5Q7Z -OEChem-04022104293D 44 49 0 1 0 0 0 0 0999 V2000 -0.2408 1.0298 1.3684 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0857 0.9816 -2.2859 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9670 -3.0409 -0.3536 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0840 -1.9626 0.0441 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8948 -1.1607 1.7868 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4913 -1.3311 -0.0067 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6647 2.6839 -0.1086 N 0 0 2 0 0 0 0 0 0 0 0 0 0.3837 1.2239 0.0997 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6859 0.3970 0.0725 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7007 3.1574 0.8206 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9401 1.0195 0.3085 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0377 2.5100 0.4862 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4786 0.8358 -1.1307 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8242 0.2788 -0.8783 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1191 -0.0788 1.5069 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1389 -0.1371 0.4185 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6519 -0.9936 -0.1591 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5329 3.5229 0.0389 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1284 0.2667 0.3054 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8366 -1.7017 -0.1476 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0419 -1.0890 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4006 -0.6744 0.6132 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7549 0.1710 -1.9306 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3152 -0.7781 -0.4117 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0229 -0.3623 -1.6939 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3952 -3.1994 -0.2307 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2180 -1.5687 1.3878 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4238 2.9507 1.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8283 4.2442 0.7363 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7522 2.7441 1.2846 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4286 2.9381 -0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6113 0.0423 2.4778 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5490 -1.0116 1.5521 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7201 -1.5157 -0.3486 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2878 4.5708 -0.1699 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9599 3.4710 1.0466 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3103 3.2512 -0.6818 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0909 0.7410 0.4688 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5042 0.5013 -2.9352 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7471 -0.4492 -2.4961 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7839 -3.6176 -1.1663 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6015 -3.9045 0.5827 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9512 -1.0183 1.9884 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3308 -2.6400 1.5902 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 15 1 0 0 0 0 2 13 2 0 0 0 0 3 20 1 0 0 0 0 3 26 1 0 0 0 0 4 21 1 0 0 0 0 4 26 1 0 0 0 0 5 22 1 0 0 0 0 5 27 1 0 0 0 0 6 24 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 7 18 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 11 1 0 0 0 0 9 17 2 0 0 0 0 10 12 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 19 2 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 14 16 2 0 0 0 0 14 23 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 16 22 1 0 0 0 0 17 20 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 18 37 1 0 0 0 0 19 21 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 22 24 2 0 0 0 0 23 25 2 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 25 40 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 M END $$$$