MDPI-ZINC03847259 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 39 0 0 1 0 0 0 0 0999 V2000 0.0260 1.3300 -0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -0.0500 -0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2450 -0.7570 -0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4240 -0.0200 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3880 1.3900 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 2.0800 -0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8050 1.8460 -0.0730 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1570 1.9580 -1.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1310 3.0980 0.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6480 3.1200 0.9830 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8380 2.8410 2.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2750 2.1410 0.0760 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9780 0.6880 0.1730 C 0 0 3 0 0 0 0 0 0 0 0 0 6.6180 0.1980 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5090 0.6220 0.5740 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3880 0.6300 1.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7480 -0.4780 -0.0390 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2350 0.1480 -1.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3300 1.1200 -1.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1080 2.3840 -0.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6120 3.4600 -1.1850 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1980 4.4970 0.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1530 4.9580 -0.4030 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 1.8380 -0.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8810 -0.5940 -0.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2570 -1.8370 -0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 3.1600 -0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8530 3.9740 0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5850 3.0960 1.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0880 -1.3320 -0.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6070 -0.8760 -1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3380 0.2170 -1.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3220 0.7130 -1.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2030 1.3190 -2.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7390 5.2110 1.7130 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0780 6.0890 1.4920 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 17 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 15 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 22 1 0 0 0 0 12 13 1 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 18 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 18 31 1 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 20 21 2 0 0 0 0 22 23 2 0 0 0 0 22 35 1 0 0 0 0 35 36 1 0 0 0 0 M END