EXO4525 -OEChem-04222010103D 74 78 0 1 0 0 0 0 0999 V2000 3.2868 -0.1177 -1.6458 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0633 1.1600 1.2085 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7600 -4.2377 0.3033 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3738 -4.1556 -0.1916 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7700 -0.9469 2.2137 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6234 0.3108 0.7121 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4666 0.9411 -2.1948 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3763 1.5719 -0.5848 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9470 -0.6406 0.5199 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3185 1.6400 -0.2965 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5858 1.3319 0.1633 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7215 -1.8126 0.2083 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4854 2.5458 0.1856 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2860 0.1198 -0.4394 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9010 -1.9766 1.1709 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1097 1.4611 0.0277 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4940 1.9157 -1.9284 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8631 -3.0762 0.1185 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0768 1.7362 -0.8525 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4565 2.6881 -0.7918 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3216 3.4926 1.1836 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4284 2.1569 -2.6986 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8932 2.0632 -2.1389 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3901 -2.9836 0.4731 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2870 3.8086 -0.7709 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1521 4.6130 1.2045 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7722 -0.7437 1.3132 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1347 4.7711 0.2274 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4453 1.2461 -1.0049 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7071 1.1788 -0.2227 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8955 0.2337 0.0986 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0639 1.0528 1.2404 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6974 0.3093 -0.6302 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8458 1.9859 0.8831 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0293 1.9237 1.6193 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9299 -0.6374 -0.2802 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2621 0.9772 1.9691 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4317 -4.2281 -0.0478 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1136 -0.6995 0.4554 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2794 0.1064 1.5778 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3781 -3.1789 0.3658 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0819 -5.2682 -0.8107 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7268 -3.1697 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4306 -5.2589 -1.1665 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2530 -4.2096 -0.7562 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3229 1.0784 1.1984 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1220 -1.6626 -0.8033 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8423 -0.3939 1.4998 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5374 -2.8046 0.8377 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5192 -2.2241 2.1695 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4756 2.0092 -2.3711 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6205 1.9679 -1.5848 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5578 3.3792 1.9475 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5356 2.4331 -3.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6978 2.3232 -2.8165 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3023 -2.6714 1.5188 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9568 -2.2389 -0.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0536 3.9316 -1.5305 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0333 5.3626 1.9813 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3484 1.6250 0.7195 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7815 5.6433 0.2438 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5601 -0.3228 -1.5048 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0891 2.6965 1.1999 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1400 2.5671 2.4898 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8223 -1.2766 -1.1541 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4135 1.5977 2.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3391 -0.1541 2.3131 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9059 -1.3775 0.1516 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2013 0.0575 2.1501 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 -2.3650 0.9848 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5558 -6.0868 -1.1319 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3686 -2.3550 0.3332 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8405 -6.0687 -1.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3033 -4.2026 -1.0324 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 2 0 0 0 0 2 16 2 0 0 0 0 3 24 1 0 0 0 0 3 38 1 0 0 0 0 4 18 2 0 0 0 0 5 27 1 0 0 0 0 5 67 1 0 0 0 0 6 27 2 0 0 0 0 7 29 2 0 0 0 0 8 11 1 0 0 0 0 8 16 1 0 0 0 0 8 17 1 0 0 0 0 9 12 1 0 0 0 0 9 14 1 0 0 0 0 9 48 1 0 0 0 0 10 19 1 0 0 0 0 10 29 1 0 0 0 0 10 60 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 11 46 1 0 0 0 0 12 15 1 0 0 0 0 12 18 1 0 0 0 0 12 47 1 0 0 0 0 13 20 2 0 0 0 0 13 21 1 0 0 0 0 15 27 1 0 0 0 0 15 49 1 0 0 0 0 15 50 1 0 0 0 0 16 19 1 0 0 0 0 17 22 2 0 0 0 0 17 51 1 0 0 0 0 18 24 1 0 0 0 0 19 23 2 0 0 0 0 20 25 1 0 0 0 0 20 52 1 0 0 0 0 21 26 2 0 0 0 0 21 53 1 0 0 0 0 22 23 1 0 0 0 0 22 54 1 0 0 0 0 23 55 1 0 0 0 0 24 56 1 0 0 0 0 24 57 1 0 0 0 0 25 28 2 0 0 0 0 25 58 1 0 0 0 0 26 28 1 0 0 0 0 26 59 1 0 0 0 0 28 61 1 0 0 0 0 29 30 1 0 0 0 0 30 33 2 0 0 0 0 30 34 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 36 2 0 0 0 0 32 35 1 0 0 0 0 32 37 2 0 0 0 0 33 62 1 0 0 0 0 34 35 2 0 0 0 0 34 63 1 0 0 0 0 35 64 1 0 0 0 0 36 39 1 0 0 0 0 36 65 1 0 0 0 0 37 40 1 0 0 0 0 37 66 1 0 0 0 0 38 41 2 0 0 0 0 38 42 1 0 0 0 0 39 40 2 0 0 0 0 39 68 1 0 0 0 0 40 69 1 0 0 0 0 41 43 1 0 0 0 0 41 70 1 0 0 0 0 42 44 2 0 0 0 0 42 71 1 0 0 0 0 43 45 2 0 0 0 0 43 72 1 0 0 0 0 44 45 1 0 0 0 0 44 73 1 0 0 0 0 45 74 1 0 0 0 0 M END $$$$