MDPI-ZINC03851979 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 1 0 0 0 0 0999 V2000 -0.5220 1.2190 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2930 -0.1820 -0.1220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4830 -0.6130 -1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0740 0.2090 -2.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8560 -0.3450 -3.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0130 -1.7140 -3.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4380 -2.5470 -2.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 -2.0020 -1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7960 -3.9840 -2.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4590 -4.0140 -3.8490 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7480 -2.5320 -4.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4610 -2.0630 -4.9890 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7420 -4.8580 -3.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3560 -5.0810 -5.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3210 -5.5610 -6.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5770 -6.5120 -6.9380 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0590 -4.7320 -6.2850 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3430 -3.7530 -6.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4570 -4.5610 -4.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0570 -5.3690 -7.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3350 -6.2930 -6.7740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4170 1.7620 0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0590 1.5940 -0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1530 1.3930 0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 1.2860 -2.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3150 0.2790 -3.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2220 -2.6380 -0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5010 -4.2920 -1.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9090 -4.6240 -2.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4950 -4.3940 -3.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5120 -5.8400 -3.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8080 -4.1650 -5.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1510 -5.8310 -5.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 -5.5300 -4.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 -3.9030 -4.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 -4.8520 -8.4010 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 27 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 13 1 0 0 0 0 10 19 1 0 0 0 0 11 12 2 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 M CHG 1 36 -1 M END