D00503 -OEChem-05072121532D 41 45 0 1 0 0 0 0 0999 V2000 2.2314 -0.2572 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1561 -2.0271 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.7122 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.0922 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1607 -1.2611 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 3.6897 -0.7855 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5133 -1.2611 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3370 -0.7855 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8660 -1.2611 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2392 -0.0881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6897 0.1655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5133 -2.2122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3370 0.1655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5918 -0.0881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5133 0.6411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6897 -2.6877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.2122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.6411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8418 -1.9932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5133 1.5922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.5922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6897 2.0677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6284 -1.5840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0496 -1.4975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3760 0.5166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6795 0.1787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7254 -2.7948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1239 -2.1045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9476 0.0579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5490 0.7481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1840 0.0957 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4989 0.5249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2912 -3.1626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0882 -3.1626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2638 -2.6377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3879 -2.4155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -2.4471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2957 -1.5709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0503 1.9022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6897 2.6877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.7122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 18 1 0 0 0 0 7 2 1 1 0 0 0 2 35 1 0 0 0 0 3 17 2 0 0 0 0 4 21 1 0 0 0 0 4 41 1 0 0 0 0 5 8 1 0 0 0 0 5 14 1 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 6 10 1 1 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 13 1 0 0 0 0 8 23 1 6 0 0 0 9 17 1 0 0 0 0 9 24 1 1 0 0 0 10 14 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 11 15 2 0 0 0 0 11 18 1 0 0 0 0 12 16 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 15 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 18 21 2 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 22 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 22 40 1 0 0 0 0 M END $$$$