B0IKM3 -OEChem-04022114413D 45 47 0 1 0 0 0 0 0999 V2000 -3.9376 -2.8135 0.5732 S 0 0 0 0 0 0 0 0 0 0 0 0 4.8347 0.4551 1.2176 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.0168 0.0327 -0.4792 N 0 0 3 0 0 0 0 0 0 0 0 0 -1.8827 3.5772 -0.3742 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7018 -1.1726 -0.5566 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9987 -0.3430 1.6756 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3418 -0.1661 0.1053 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7045 1.3584 -1.0007 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0096 -0.9088 -0.2564 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9003 -1.5281 -0.2554 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2259 2.2549 0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2830 -2.2128 0.2224 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6531 -0.6072 -0.5138 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2422 -3.1337 0.4503 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3751 -1.5283 -0.2919 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0806 -2.7918 0.1941 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4332 4.4480 0.7031 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0830 5.8311 0.1812 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4194 -0.6241 0.3904 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8315 -0.2667 0.0324 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4878 -0.4361 -1.1669 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8321 0.0327 -1.1118 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1519 0.5426 0.1272 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3010 -0.0179 1.1926 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0366 0.5911 -0.2787 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6063 1.7961 -1.4499 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9856 1.3108 -1.8277 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8735 -1.6952 -1.3377 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9406 -1.6120 0.0734 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3610 1.8182 0.6454 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0247 2.3440 0.8813 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3533 0.3659 -0.8951 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4536 -4.1335 0.8247 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1514 3.4967 -1.0802 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8686 -3.5180 0.3733 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2207 4.5511 1.4588 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5501 4.0233 1.1953 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2719 5.7837 -0.5532 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9485 6.3049 -0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7555 6.4744 1.0042 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0360 -0.8740 -2.0479 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6190 0.0872 2.3539 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0582 -0.5523 1.9915 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5292 -0.0022 -1.9389 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0962 0.9624 0.4442 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 12 1 0 0 0 0 2 20 1 0 0 0 0 2 23 1 0 0 0 0 3 7 1 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 4 11 1 0 0 0 0 4 17 1 0 0 0 0 4 34 1 0 0 0 0 5 15 1 0 0 0 0 5 19 2 0 0 0 0 6 19 1 0 0 0 0 6 42 1 0 0 0 0 6 43 1 0 0 0 0 7 10 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 11 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 12 2 0 0 0 0 9 13 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 14 1 0 0 0 0 13 15 2 0 0 0 0 13 32 1 0 0 0 0 14 16 2 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 M END $$$$