L1I3UT -OEChem-05022322513D 39 42 0 0 0 0 0 0 0999 V2000 4.1213 3.8052 0.1558 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.4942 -1.4421 0.0969 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.8830 0.3630 1.9246 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0719 0.9387 -0.0508 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0663 2.2183 0.0494 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2711 1.2126 0.1255 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2564 -0.1574 0.0235 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9305 -1.5498 -0.0095 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4772 1.0041 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7619 2.1019 -0.0685 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6317 0.0275 0.0825 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 -2.1574 -0.0715 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2087 1.7080 -0.1782 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0488 -2.3542 0.0251 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 -2.4682 1.1055 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0425 -2.4346 -1.3082 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8832 1.2123 0.9376 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8765 1.8387 -1.3957 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4122 2.2475 0.1051 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3195 -3.0561 1.0458 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2210 -3.0224 -1.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2254 0.8469 0.8357 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2188 1.4733 -1.4977 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9020 -3.3332 -0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8932 0.9775 -0.3819 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6221 2.6928 0.8457 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4902 2.7547 -0.9077 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3674 0.0302 -0.0843 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0982 -3.4350 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3829 -2.2570 2.0778 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5590 -2.1972 -2.2352 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3671 1.1075 1.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3630 2.2212 -2.2738 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8505 -3.2967 1.9621 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6752 -3.2371 -2.3309 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7386 1.5742 -2.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8863 -3.7897 -0.2375 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9388 0.6961 -0.4745 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8008 0.1606 1.6741 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 2 11 1 0 0 0 0 2 14 1 0 0 0 0 3 22 1 0 0 0 0 3 39 1 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 4 28 1 0 0 0 0 5 9 1 0 0 0 0 5 19 2 0 0 0 0 6 11 2 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 9 2 0 0 0 0 7 11 1 0 0 0 0 8 12 1 0 0 0 0 8 14 2 0 0 0 0 10 13 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 12 15 2 0 0 0 0 12 16 1 0 0 0 0 13 17 2 0 0 0 0 13 18 1 0 0 0 0 14 29 1 0 0 0 0 15 20 1 0 0 0 0 15 30 1 0 0 0 0 16 21 2 0 0 0 0 16 31 1 0 0 0 0 17 22 1 0 0 0 0 17 32 1 0 0 0 0 18 23 2 0 0 0 0 18 33 1 0 0 0 0 20 24 2 0 0 0 0 20 34 1 0 0 0 0 21 24 1 0 0 0 0 21 35 1 0 0 0 0 22 25 2 0 0 0 0 23 25 1 0 0 0 0 23 36 1 0 0 0 0 24 37 1 0 0 0 0 25 38 1 0 0 0 0 M END $$$$