B2ISQ0 -OEChem-04022106263D 25 26 0 1 0 0 0 0 0999 V2000 1.7813 0.7570 0.2601 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.8655 0.6227 -0.6117 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8955 0.2068 -0.8087 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6309 -1.0863 -1.1802 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5243 -1.3983 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6488 -0.0812 0.6934 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5358 0.0413 -0.3505 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6585 2.1508 0.7198 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8538 -0.8005 0.7077 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5666 0.7248 -0.9723 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1790 -0.9319 1.1077 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1386 -0.2051 0.4216 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9433 0.9049 -1.6537 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2663 -0.9029 -2.0573 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9681 -1.9194 -1.4364 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5076 -1.7663 -0.2927 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0774 -2.1224 0.7003 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3642 0.1410 1.4915 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7160 2.8068 -0.1524 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4730 2.3801 1.4124 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6961 2.2659 1.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0936 -1.3623 1.2401 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3811 1.3974 -1.8038 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4522 -1.5817 1.9311 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1865 -0.2722 0.6948 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 6 2 0 0 0 0 1 8 1 0 0 0 0 2 10 1 0 0 0 0 2 12 2 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 14 1 0 0 0 0 4 15 1 0 0 0 0 5 6 1 0 0 0 0 5 16 1 0 0 0 0 5 17 1 0 0 0 0 6 18 1 0 0 0 0 7 9 1 0 0 0 0 7 10 2 0 0 0 0 8 19 1 0 0 0 0 8 20 1 0 0 0 0 8 21 1 0 0 0 0 9 11 2 0 0 0 0 9 22 1 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 11 24 1 0 0 0 0 12 25 1 0 0 0 0 M CHG 1 1 1 M END $$$$