B8TAW3 -OEChem-04042104563D 49 51 0 0 0 0 0 0 0999 V2000 2.0959 0.4390 -1.2399 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2128 -2.8636 -0.1872 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3755 -1.0147 1.0005 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8103 -0.5334 -0.9543 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5028 2.2157 1.9353 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8926 -2.2443 0.6099 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2013 -1.4114 -0.6434 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6515 -1.7908 1.3853 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3138 0.0744 -0.4064 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3380 -1.9664 0.6423 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0646 0.2627 0.5039 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9264 -0.8859 0.5171 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5587 -0.6324 -0.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2550 0.9278 -0.7163 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7527 0.1297 0.9894 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4933 0.5920 0.1284 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9177 1.2758 0.9619 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4064 -1.7710 -0.4403 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7108 -1.6386 -0.9229 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3757 2.2991 -0.4912 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2080 1.3804 0.4628 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6019 0.4586 -0.4858 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6142 1.9635 0.3535 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5554 2.8170 0.0438 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9806 0.5336 -1.0519 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0660 1.3832 -1.5265 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7875 -3.2957 0.3161 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7529 -2.1953 1.2895 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1452 -1.7677 -1.0776 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4488 -1.6182 -1.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7660 -0.7537 1.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5700 -2.3977 2.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6460 -0.3301 1.7031 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3460 0.8051 1.7366 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3251 -0.0626 0.3746 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8349 -2.5863 -0.8607 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0644 -2.3441 -1.6728 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8850 2.1575 0.8034 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5965 3.0221 -0.7057 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5325 2.3666 0.7703 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6505 3.8846 0.2199 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1353 1.4952 -1.5516 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1476 -0.2598 -1.7879 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7252 0.4189 -0.2577 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1526 2.9309 2.2368 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5799 2.2011 2.3412 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7049 1.8760 -0.6175 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3779 2.1003 -2.2935 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2224 0.8242 -1.9443 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 26 1 0 0 0 0 2 10 2 0 0 0 0 3 10 1 0 0 0 0 3 12 1 0 0 0 0 3 33 1 0 0 0 0 4 13 2 0 0 0 0 4 22 1 0 0 0 0 5 17 1 0 0 0 0 5 45 1 0 0 0 0 5 46 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 27 1 0 0 0 0 6 28 1 0 0 0 0 7 9 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 10 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 14 1 0 0 0 0 9 16 2 0 0 0 0 11 13 1 0 0 0 0 11 15 1 0 0 0 0 11 17 2 0 0 0 0 12 15 2 0 0 0 0 12 18 1 0 0 0 0 13 19 1 0 0 0 0 14 20 2 0 0 0 0 15 34 1 0 0 0 0 16 23 1 0 0 0 0 16 35 1 0 0 0 0 17 21 1 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 20 24 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 25 1 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 M END $$$$