B6C3IU -OEChem-04022107433D 42 43 0 1 0 0 0 0 0999 V2000 2.1915 1.8553 0.2024 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5853 2.2949 -1.1227 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2823 2.7637 1.3294 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0121 -2.9410 -0.1969 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9474 -1.6782 1.6870 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0125 0.4189 0.5879 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3459 -1.1481 -0.8036 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9378 -0.7426 -0.3284 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9747 -0.0452 -1.6637 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2739 -1.4446 0.3809 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5139 1.3048 0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2645 -1.8099 0.5119 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2851 1.3251 1.2612 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0105 0.8488 -1.0915 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1330 0.4336 -0.0145 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6084 0.8895 1.1949 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 0.4131 -1.1577 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5054 -0.0197 -0.0831 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8098 -1.3604 0.1521 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5240 0.8843 -0.3844 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1330 -1.7971 0.0862 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8471 0.4476 -0.4503 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1516 -0.8932 -0.2151 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2673 -2.0576 -1.4122 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3076 -0.5331 -1.1945 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3388 0.2528 1.5478 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1556 0.8698 -1.0903 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3263 0.2024 -2.5105 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9366 -0.3778 -2.0688 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4535 -0.5603 1.0009 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2490 -1.7884 0.0175 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8718 -2.2372 1.0196 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 1.6683 2.2151 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5887 0.8314 -1.9971 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2170 0.9099 2.0959 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7275 0.0621 -2.1088 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5627 -3.6212 0.3486 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0279 -2.0783 0.3882 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3041 1.9330 -0.5705 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3701 -2.8410 0.2693 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6404 1.1514 -0.6848 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1818 -1.2332 -0.2665 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 6 1 0 0 0 0 1 11 1 0 0 0 0 4 12 1 0 0 0 0 4 37 1 0 0 0 0 5 12 2 0 0 0 0 6 8 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 7 24 1 0 0 0 0 8 12 1 0 0 0 0 8 25 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 13 16 1 0 0 0 0 13 33 1 0 0 0 0 14 17 2 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 16 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 19 21 1 0 0 0 0 19 38 1 0 0 0 0 20 22 2 0 0 0 0 20 39 1 0 0 0 0 21 23 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 42 1 0 0 0 0 M END $$$$