MDPI-ZINC03847518 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 1 0 0 0 0 0999 V2000 0.1180 1.4700 -0.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1650 -0.0400 -0.6160 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7370 -0.5190 -1.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8240 -0.3150 0.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2040 -0.5970 1.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1270 -0.7870 2.8590 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9190 -1.0030 3.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 -0.6280 2.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2640 -0.3300 0.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4010 -0.1210 0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6410 -0.2090 0.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7780 -0.5050 2.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6690 -0.7080 2.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6620 -0.8750 -1.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0860 -1.4310 -1.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1020 -2.6280 -1.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3060 -3.3880 -1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9540 -0.4640 -1.3190 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3270 -0.6090 -1.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1320 1.8680 -0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 1.6680 -1.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4540 1.9480 -0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8670 -0.6640 1.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 0.1100 -0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5200 -0.0470 0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7650 -0.5710 2.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7860 -0.9400 3.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0000 -1.6130 -2.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6500 0.0380 -2.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4280 -1.6520 -2.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0850 -2.9370 -0.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6240 -3.3960 -2.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1270 -4.4100 -0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9020 0.2220 -1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4120 -0.6130 -2.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7120 -1.5480 -1.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2020 -0.5770 -0.6040 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2640 -1.3940 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 37 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 24 1 0 0 0 0 11 12 2 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 14 29 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 37 38 1 0 0 0 0 M END