B4NQ0Z -OEChem-04022109013D 22 21 0 1 0 0 0 0 0999 V2000 -2.3997 1.4960 -0.0078 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2698 1.8470 0.0897 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9546 -0.0873 -1.5679 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8175 0.4201 0.9326 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1986 -1.3705 -1.0542 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 -1.2048 0.1929 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1100 -0.3928 0.6994 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1542 -0.4371 -0.6193 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.0775 -1.2225 1.5429 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8448 0.3269 -0.4213 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8475 0.6251 0.2128 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5820 -1.6664 1.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2779 -2.0340 -0.4223 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7071 0.3908 1.3554 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7233 0.0243 -1.5128 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5642 -1.6698 2.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5202 -2.0287 0.9482 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8978 -0.6032 1.9211 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6487 -1.7966 -0.2449 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9250 -0.8670 -1.5618 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8794 1.9495 -0.7335 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7226 2.5227 0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 21 1 0 0 0 0 2 11 1 0 0 0 0 2 22 1 0 0 0 0 3 10 2 0 0 0 0 4 11 2 0 0 0 0 5 8 1 0 0 0 0 5 19 1 0 0 0 0 5 20 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 12 1 0 0 0 0 6 13 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 7 14 1 0 0 0 0 8 11 1 0 0 0 0 8 15 1 0 0 0 0 9 16 1 0 0 0 0 9 17 1 0 0 0 0 9 18 1 0 0 0 0 M END $$$$