B5GDO4 -OEChem-04022114253D 28 28 0 0 0 0 0 0 0999 V2000 -2.6433 2.2074 0.8737 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5363 -2.3489 -0.5975 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9764 -0.0649 0.0196 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5987 -0.8076 2.7944 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0109 0.2273 -0.2342 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5100 0.9898 -2.8457 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1618 -0.0819 0.3722 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9500 1.0759 0.5659 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8960 -1.2226 -0.1765 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5061 -1.2282 -0.0582 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5602 1.0702 0.6843 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6179 -0.0705 0.1355 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6111 -0.0877 0.4951 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4366 0.2646 -0.5358 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8689 3.1370 -0.1843 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7238 -3.4828 -0.8956 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1702 -0.4851 1.7651 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8580 0.2433 -0.3674 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9219 0.6646 -1.8105 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1053 -2.0955 -0.2872 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0479 1.9690 1.0214 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2615 -0.9418 -0.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4385 3.9802 0.2161 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4488 2.6731 -0.9884 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9173 3.5113 -0.5749 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3969 -4.2856 -1.2146 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1959 -3.8464 -0.0074 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0466 -3.2856 -1.7337 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 15 1 0 0 0 0 2 9 1 0 0 0 0 2 16 1 0 0 0 0 3 12 1 0 0 0 0 3 22 1 0 0 0 0 4 17 3 0 0 0 0 5 18 3 0 0 0 0 6 19 3 0 0 0 0 7 10 2 0 0 0 0 7 11 1 0 0 0 0 7 13 1 0 0 0 0 8 11 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 12 2 0 0 0 0 10 20 1 0 0 0 0 11 21 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 18 1 0 0 0 0 14 19 1 0 0 0 0 15 23 1 0 0 0 0 15 24 1 0 0 0 0 15 25 1 0 0 0 0 16 26 1 0 0 0 0 16 27 1 0 0 0 0 16 28 1 0 0 0 0 M END $$$$