6274 -OEChem-03282413063D 20 20 0 1 0 0 0 0 0999 V2000 -1.0689 -1.6919 -0.7660 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4946 -1.1223 0.9038 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6797 0.1409 1.1624 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7494 1.3693 -0.2178 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8201 -0.3365 -0.6825 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3579 1.3004 0.3217 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5062 0.6397 -0.4567 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9671 0.6020 0.1195 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7498 -0.7917 -0.0102 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6556 0.3150 -1.0031 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8043 -0.4249 0.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5942 1.3196 1.3946 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2433 2.3450 0.0039 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3124 0.6416 -1.5355 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4441 0.1943 2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3992 0.5299 -2.0301 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6419 2.3346 -0.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9358 1.4198 0.7835 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5655 -0.8810 1.2458 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2415 -2.6142 -0.4801 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 20 1 0 0 0 0 2 9 2 0 0 0 0 3 8 1 0 0 0 0 3 11 1 0 0 0 0 3 15 1 0 0 0 0 4 7 1 0 0 0 0 4 17 1 0 0 0 0 4 18 1 0 0 0 0 5 10 1 0 0 0 0 5 11 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 12 1 0 0 0 0 6 13 1 0 0 0 0 7 9 1 0 0 0 0 7 14 1 0 0 0 0 8 10 2 0 0 0 0 10 16 1 0 0 0 0 11 19 1 0 0 0 0 M END > 6274 > 0.6 > 1 9 16 12 4 20 7 8 14 15 3 6 2 11 19 17 10 5 13 18 > 17 1 -0.65 10 0.08 11 0.04 15 0.27 16 0.15 17 0.36 18 0.36 19 0.15 2 -0.57 20 0.5 3 0.03 4 -0.99 5 -0.57 6 0.18 7 0.33 8 -0.33 9 0.66 > 3 > 8 1 1 acceptor 1 2 acceptor 1 3 donor 1 4 cation 1 4 donor 3 1 2 9 anion 3 3 5 11 cation 5 3 5 8 10 11 rings > 11 > 1 > 0 > 0 > 0 > 0 > 1 > 2 > 0000188200000001 > 7.9539 > 40.654 > 12897270 3 14056993979206604083 12932764 1 18271807968700595688 15310529 11 17895482521612900700 16945 1 17969215655460391109 20201158 50 17632574907814046286 20645464 45 17846491543443691394 23235685 24 18339075965433964901 23552423 10 17968380168362411957 29004967 10 17203891859937136848 369184 2 14908180854499463455 > 199.69 4.3 1.38 1 0.59 0.14 -0.02 0.46 -0.2 -1.01 0.05 0.32 0.1 0.1 > 409.56 > 117.2 > 2 5 10 $$$$