MDPI-ZINC04265640 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 1 0 0 0 0 0999 V2000 1.4130 -1.3990 1.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5480 -0.4860 0.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0250 -0.5400 -0.7440 N 0 3 0 0 0 0 0 0 0 0 0 0 0.3110 0.3780 -1.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 1.6800 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7740 2.4220 -2.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0990 1.8720 -3.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7220 0.5740 -3.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -0.1670 -2.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4990 -1.5900 -2.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7900 -1.8900 -1.3020 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6790 -2.5120 -1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4000 -2.5410 -0.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2610 -3.7700 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3520 -4.3670 0.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5820 -3.7350 0.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7200 -2.5060 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6280 -1.9070 -0.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4590 -0.2250 -0.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7100 1.1130 -0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3420 -2.4240 1.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4510 -1.0680 1.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0630 -1.3550 2.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4890 -0.8200 0.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6150 0.5380 1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 2.1150 -0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0700 3.4350 -1.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6470 2.4530 -4.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9740 0.1400 -4.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 -2.2690 -3.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4120 -1.6510 -3.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6990 -4.2640 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 -5.3280 1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4340 -4.2020 1.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6810 -2.0130 -0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7350 -0.9440 -1.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0200 -1.0110 -0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7830 -0.1600 -1.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1120 1.8890 -0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4320 1.0320 0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7670 1.3700 -0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 3 19 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 2 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 M CHG 1 3 1 M END