MDPI-ZINC03847260 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 39 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3760 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 1.1880 -0.7220 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3750 0.0120 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3440 1.4100 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 2.1180 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7720 1.9140 0.0240 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9070 2.6710 0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0850 2.4760 -1.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5920 2.6760 -1.5450 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8030 3.0310 -2.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2110 1.3560 -1.3320 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9660 0.5640 -0.1220 C 0 0 3 0 0 0 0 0 0 0 0 0 6.6030 0.9360 0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5440 0.6380 0.3570 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5540 0.5570 1.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6860 -0.4540 -0.1140 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3920 -0.8750 -0.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4180 -0.6320 -1.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0210 0.7100 -2.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3830 1.1370 -3.2600 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1100 3.6640 -0.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9610 3.3280 0.2590 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9660 1.8910 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9350 -0.5410 0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 -1.8020 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 3.1980 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7220 1.7830 -2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5800 3.4350 -1.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9740 -1.3290 -0.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8630 -1.3610 0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5440 -1.4570 -0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4290 -0.5900 -1.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3410 -1.4120 -2.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6270 4.9160 -0.5060 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9900 5.5130 0.1620 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