LM0D5W -OEChem-05032301583D 39 41 0 0 0 0 0 0 0999 V2000 4.1812 1.2507 -0.5216 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0839 1.9931 1.8830 F 0 0 0 0 0 0 0 0 0 0 0 0 1.1598 3.6055 -0.3120 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2654 -2.2381 1.0117 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6907 -1.6600 -1.1765 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5972 1.2759 -0.2358 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4796 -2.1480 0.4637 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 0.8856 -0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6860 0.4096 -0.2787 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9300 2.6483 -0.2799 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4224 2.8654 -0.3105 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4687 0.1242 -0.1257 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5902 1.2644 0.8778 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3232 0.1260 -1.2364 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9315 0.8837 0.9135 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6646 -0.2548 -1.2006 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8598 -0.2721 -0.0876 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6863 -0.9153 -0.0778 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7978 0.5368 0.5536 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2627 -1.4628 -0.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1390 0.1552 0.5905 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6038 -1.8446 -0.6552 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9887 -1.6314 -0.1755 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5420 -1.0357 -0.0139 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4697 -1.5939 0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4961 -2.9678 1.0629 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6835 3.5174 -1.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7411 3.3170 0.6326 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2819 -0.1538 -2.0956 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5103 1.1766 1.7849 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0474 -0.8161 -2.0485 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5364 1.4871 1.0111 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5637 -2.1395 -1.1759 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8710 0.7879 1.0839 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9172 -2.7750 -1.1199 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5861 -1.3330 0.0148 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5939 -3.3994 2.0626 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3416 -2.2963 0.8857 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4856 -3.7793 0.3291 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 11 1 0 0 0 0 2 13 1 0 0 0 0 3 10 2 0 0 0 0 4 23 1 0 0 0 0 4 26 1 0 0 0 0 5 23 2 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 6 10 1 0 0 0 0 7 25 3 0 0 0 0 8 13 2 0 0 0 0 8 14 1 0 0 0 0 9 18 2 0 0 0 0 10 11 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 12 15 2 0 0 0 0 12 16 1 0 0 0 0 12 17 1 0 0 0 0 13 15 1 0 0 0 0 14 16 2 0 0 0 0 14 29 1 0 0 0 0 15 30 1 0 0 0 0 16 31 1 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 18 23 1 0 0 0 0 18 25 1 0 0 0 0 19 21 1 0 0 0 0 19 32 1 0 0 0 0 20 22 2 0 0 0 0 20 33 1 0 0 0 0 21 24 2 0 0 0 0 21 34 1 0 0 0 0 22 24 1 0 0 0 0 22 35 1 0 0 0 0 24 36 1 0 0 0 0 26 37 1 0 0 0 0 26 38 1 0 0 0 0 26 39 1 0 0 0 0 M END $$$$