LC3AU4 -OEChem-05022323093D 42 45 0 0 0 0 0 0 0999 V2000 -5.5775 1.7073 -0.3097 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -5.6532 -3.7124 0.1468 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.3823 -0.8612 0.1230 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1879 3.2709 -0.0102 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8378 -1.0007 -0.1258 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3505 -1.8867 -0.0786 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5490 0.9166 0.0317 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3369 1.1598 -0.0738 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3996 2.6407 -0.2175 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1274 0.4828 0.0336 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1797 3.3155 0.4263 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3743 0.1927 -0.0461 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1395 1.1223 0.0482 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7321 -1.0332 0.0773 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1494 2.6244 0.1122 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7786 0.2116 -0.1159 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3935 -2.2585 0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2840 0.4307 0.0218 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4719 -1.0048 -0.0539 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7892 -2.2168 0.0725 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7626 0.2077 0.0042 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9779 0.8965 0.0198 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7595 -1.1889 -0.0396 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1824 0.1935 -0.0081 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9639 -1.8918 -0.0673 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1753 -1.2007 -0.0516 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5520 -1.1175 -0.0601 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4351 2.8886 -1.2853 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2926 3.0580 0.2536 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2842 3.3258 1.5183 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1236 4.3552 0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8437 -3.1881 0.2374 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2138 -0.6492 -0.0187 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6432 1.9259 0.0662 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1391 -0.0796 -0.2119 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9974 1.9832 0.0537 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8527 -1.7829 -0.0535 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0864 0.7928 0.0063 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9532 -2.9779 -0.1011 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6477 -0.5428 0.8673 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6393 -0.4860 -0.9507 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3883 -1.8237 -0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 2 20 1 0 0 0 0 3 10 1 0 0 0 0 3 14 1 0 0 0 0 4 15 2 0 0 0 0 5 19 1 0 0 0 0 5 35 1 0 0 0 0 6 26 1 0 0 0 0 6 27 1 0 0 0 0 7 18 1 0 0 0 0 7 21 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 8 12 1 0 0 0 0 9 11 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 13 1 0 0 0 0 11 15 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 12 16 2 0 0 0 0 13 15 1 0 0 0 0 13 18 2 0 0 0 0 14 17 2 0 0 0 0 16 19 1 0 0 0 0 17 20 1 0 0 0 0 17 32 1 0 0 0 0 18 33 1 0 0 0 0 19 20 2 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 22 24 1 0 0 0 0 22 36 1 0 0 0 0 23 25 2 0 0 0 0 23 37 1 0 0 0 0 24 26 2 0 0 0 0 24 38 1 0 0 0 0 25 26 1 0 0 0 0 25 39 1 0 0 0 0 27 40 1 0 0 0 0 27 41 1 0 0 0 0 27 42 1 0 0 0 0 M END $$$$