BX5E8Y -OEChem-04022114423D 40 43 0 0 0 0 0 0 0999 V2000 -3.6079 0.4815 -1.2833 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.7736 1.3541 -1.3872 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9879 -0.0043 -2.5120 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0095 0.7443 -0.0127 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0353 -0.8596 -0.2877 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8760 2.9775 1.3309 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6600 -1.3857 -0.5370 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2484 0.2164 -0.1749 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8988 -2.0130 -0.7484 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3241 1.3574 0.2082 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1159 1.6691 0.3134 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4037 1.3053 -0.3335 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0548 0.9912 -0.4565 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6837 0.0938 -0.1193 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0600 -0.2546 -0.2393 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3556 2.3737 0.4358 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6524 2.0484 0.3223 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 2.6447 1.1843 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7594 2.2974 0.5661 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9751 -1.6912 0.2152 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9775 -1.0504 -0.4852 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1285 -2.3546 -0.6729 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7935 -1.8344 1.5907 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1002 -3.1614 -0.1854 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7653 -2.6410 2.0782 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9187 -3.3046 1.1901 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7527 0.2454 -1.1855 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9722 -0.7091 -0.2739 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0751 3.3929 0.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8071 -0.7006 0.3733 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4529 2.7621 0.4737 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0911 3.2052 1.8336 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7938 2.5889 0.7172 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2643 -2.2841 -1.7474 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4458 -1.3204 2.2919 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4440 -3.6822 -0.8767 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6233 -2.7518 3.1492 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1183 -3.9329 1.5696 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6349 -2.9653 -0.9802 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8964 -1.8273 -0.7262 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 5 1 0 0 0 0 1 12 1 0 0 0 0 4 8 1 0 0 0 0 4 15 1 0 0 0 0 4 17 1 0 0 0 0 5 20 1 0 0 0 0 5 30 1 0 0 0 0 6 18 2 0 0 0 0 6 19 1 0 0 0 0 7 15 2 0 0 0 0 7 21 1 0 0 0 0 8 21 2 0 0 0 0 9 21 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 14 2 0 0 0 0 10 16 1 0 0 0 0 11 13 2 0 0 0 0 11 18 1 0 0 0 0 12 13 1 0 0 0 0 12 19 2 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 16 17 2 0 0 0 0 16 29 1 0 0 0 0 17 31 1 0 0 0 0 18 32 1 0 0 0 0 19 33 1 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 22 24 1 0 0 0 0 22 34 1 0 0 0 0 23 25 2 0 0 0 0 23 35 1 0 0 0 0 24 26 2 0 0 0 0 24 36 1 0 0 0 0 25 26 1 0 0 0 0 25 37 1 0 0 0 0 26 38 1 0 0 0 0 M END $$$$