IFLAB-ZINC04939568 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 1 0 0 0 0 0999 V2000 0.8860 -0.4420 1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3300 -0.4320 2.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1160 -0.1060 3.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 1.6820 3.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2220 1.3560 2.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7800 1.6920 4.8280 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6380 2.7500 5.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2580 1.4250 4.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7160 2.3090 3.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9650 3.1430 2.9470 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9600 2.1750 2.9080 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3520 2.9240 1.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4310 3.2200 0.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8190 3.9600 -0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1250 4.4050 -0.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0460 4.1100 0.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6630 3.3660 1.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5030 5.1280 -1.4920 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 0.8700 6.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 0.1010 5.9070 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5100 0.0840 0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8170 -1.5180 0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9260 -0.1660 1.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4090 -1.4980 1.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7370 0.1370 1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1690 -0.3440 3.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7270 -0.6960 4.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1570 1.1120 4.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4850 2.7480 4.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1670 1.9460 1.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2750 1.5940 2.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3900 0.3800 4.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8480 1.6400 5.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5850 1.5580 3.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4120 2.8740 0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1030 4.1910 -1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0640 4.4590 0.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3820 3.1330 2.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -0.0740 2.2710 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9760 1.3240 3.6550 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9840 0.9920 7.1870 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6680 0.4440 7.9180 H 0 0 0 0 0 0 0 0 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 1 39 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 2 39 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 4 40 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 19 1 0 0 0 0 6 40 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 41 42 1 0 0 0 0 M END