LM0D5W -OEChem-05032301322D 39 41 0 0 0 0 0 0 0999 V2000 4.2601 3.5758 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0280 1.0370 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.3158 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2144 2.6759 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0554 3.9630 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 2.0370 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9360 0.3594 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 1.0370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5691 2.6248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9511 2.6248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2601 3.5758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 -0.9630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 0.5370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6261 0.5370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 -0.4630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6261 -0.4630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 -1.9630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5202 2.3158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 -2.4630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6261 -2.4630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 -3.4630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6261 -3.4630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2633 2.9849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 -3.9630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7281 1.3376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9575 3.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3249 4.1924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6536 3.7047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1630 0.8470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3571 -0.7730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1630 -0.7730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3571 -2.1530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1630 -2.1530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3571 -3.7730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1630 -3.7730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 -4.5830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3724 2.8842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4182 3.7598 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5426 3.8057 0.0000 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 $$$$