B5PVI0 -OEChem-04022115403D 42 46 0 1 0 0 0 0 0999 V2000 -3.3233 2.0481 0.0741 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7114 -0.9236 -1.9495 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7426 3.2402 -0.0268 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8198 -2.5747 0.1777 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0983 -0.9189 0.5756 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.6458 -0.3389 0.4317 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.2201 0.0651 0.4557 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3813 -2.0521 -0.4534 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8591 -1.4304 -0.6231 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.8370 -2.5638 -0.4421 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2554 -0.2489 0.2944 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3294 1.0098 0.1588 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1321 1.3668 0.2335 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0852 -1.4786 2.0149 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3696 1.1416 0.0927 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8279 2.0254 0.0981 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4328 -1.0204 0.2567 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6218 1.7306 -0.1367 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6931 -0.4423 0.0259 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7882 0.9515 -0.1725 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8612 -1.2221 -0.0094 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0482 1.5290 -0.4025 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1050 -0.6336 -0.2386 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1984 0.7403 -0.4351 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9518 -0.7181 1.4142 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1496 -1.6960 -1.4675 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7170 -2.9076 -0.2771 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8781 -1.8246 -0.5393 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9483 -3.2978 -1.2494 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0345 -3.0894 0.4993 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9141 1.0167 -0.7673 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0075 1.2714 0.9795 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0475 -1.9173 2.3002 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8576 -0.6919 2.7454 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3297 -2.2632 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3594 -2.0946 0.4177 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8940 -1.6534 -2.5655 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6987 2.8053 -0.2941 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1446 2.6015 -0.5585 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0100 -1.2347 -0.2666 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1662 1.1997 -0.6138 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7209 -2.9356 0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 13 1 0 0 0 0 2 9 1 0 0 0 0 2 37 1 0 0 0 0 3 16 2 0 0 0 0 4 21 1 0 0 0 0 4 42 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 5 11 1 0 0 0 0 5 14 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 6 12 1 0 0 0 0 6 25 1 0 0 0 0 7 13 2 0 0 0 0 8 10 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 15 2 0 0 0 0 11 17 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 16 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 17 19 2 0 0 0 0 17 36 1 0 0 0 0 18 20 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 22 1 0 0 0 0 21 23 2 0 0 0 0 22 24 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 M END $$$$