MDPI-ZINC04262757 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 34 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3830 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 -0.6850 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 0.0190 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3760 1.4250 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 2.0990 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6970 1.8300 -0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0190 2.7450 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 0.6970 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6950 -0.3640 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9420 0.6730 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6180 1.8010 -0.0520 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9070 1.7800 -0.0640 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6250 2.9780 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0140 2.9560 -0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7230 4.1410 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0480 5.3540 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6600 5.3760 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9500 4.1930 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7460 6.5200 -0.0700 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6380 -0.5780 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1900 -1.5710 -0.0730 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9070 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.5510 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 -1.7650 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 3.1780 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3790 0.9320 -0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5400 2.0130 -0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8020 4.1240 -0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1360 6.3210 -0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8700 4.2110 -0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9400 6.8610 -0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 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 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 28 1 0 0 0 0 16 17 1 0 0 0 0 16 29 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 30 1 0 0 0 0 19 31 1 0 0 0 0 20 32 1 0 0 0 0 21 22 3 0 0 0 0 M END