B0QIS4 -OEChem-04022117163D 38 39 0 1 0 0 0 0 0999 V2000 -4.1229 -1.2242 0.0985 P 0 0 0 0 0 0 0 0 0 0 0 0 -0.5527 0.9718 1.1255 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4607 3.8378 0.2607 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4891 2.6959 -1.2644 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1039 -0.0863 0.6357 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2501 -2.0356 -0.9947 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1623 -0.3798 -0.8079 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7539 -2.0660 1.1688 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1718 -3.6503 -0.4258 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3704 -0.0927 0.2383 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5203 0.8754 0.4538 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3828 -1.4007 0.0093 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8161 2.6791 -0.4931 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4205 1.8757 -0.8361 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.5661 1.7304 0.4307 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7171 1.1691 0.4772 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.4660 0.7517 -0.3119 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7728 -0.2562 0.2245 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6327 -1.2476 -0.0019 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1731 -2.4461 -0.2296 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6568 -2.5537 -0.2243 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9475 0.8521 0.4668 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3802 3.0071 -1.3709 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1943 1.1592 -1.6351 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1437 2.2591 1.1973 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2863 1.8037 1.1638 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9037 0.1369 -1.0188 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2273 1.3067 -0.8695 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2854 4.2997 0.4898 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1821 3.1931 -2.0416 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4418 -1.1430 0.0081 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5774 -3.3314 -0.4111 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0924 1.7935 0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3257 0.1835 1.2467 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3358 1.8544 0.6731 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3472 0.5334 -0.5012 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6385 -2.8315 -1.4162 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9462 -0.8364 -1.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 1 6 1 0 0 0 0 1 7 1 0 0 0 0 1 8 2 0 0 0 0 2 15 1 0 0 0 0 2 16 1 0 0 0 0 3 13 1 0 0 0 0 3 29 1 0 0 0 0 4 14 1 0 0 0 0 4 30 1 0 0 0 0 5 17 1 0 0 0 0 6 37 1 0 0 0 0 7 38 1 0 0 0 0 9 21 2 0 0 0 0 10 16 1 0 0 0 0 10 18 1 0 0 0 0 10 19 1 0 0 0 0 11 18 1 0 0 0 0 11 22 1 0 0 0 0 11 33 1 0 0 0 0 12 18 2 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 23 1 0 0 0 0 14 16 1 0 0 0 0 14 24 1 0 0 0 0 15 17 1 0 0 0 0 15 25 1 0 0 0 0 16 26 1 0 0 0 0 17 27 1 0 0 0 0 17 28 1 0 0 0 0 19 20 2 0 0 0 0 19 31 1 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 M END $$$$