IFLAB-ZINC04248469 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 0 0 0 0 0 0999 V2000 -0.2820 3.5090 1.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0190 2.0860 1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2560 1.6190 0.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4850 0.2900 0.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4480 -0.5230 0.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 -0.0680 0.3700 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0920 1.2230 0.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4060 1.3980 0.7570 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 0.2590 0.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0460 -0.6640 0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4860 0.0430 0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1650 0.4130 1.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6100 0.2030 1.4720 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4170 0.4640 2.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9460 0.8750 3.5620 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.8760 0.2520 2.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5900 0.8570 1.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9530 0.6550 1.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6170 -0.1460 2.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9250 -0.7540 3.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5500 -0.5670 3.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8040 -1.2210 4.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5930 -1.1480 4.4590 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 4.0120 1.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 4.0300 0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8870 3.5150 2.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0880 2.2680 1.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4960 -0.0830 0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6360 -1.5430 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2080 -1.6840 -0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8810 0.6700 -0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6840 -1.0040 0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7710 -0.2150 2.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9680 1.4600 1.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9860 -0.1250 0.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0780 1.4840 0.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5040 1.1260 0.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6820 -0.2960 2.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4500 -1.3780 3.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4690 -1.8980 5.3780 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9380 -2.3080 6.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 40 41 1 0 0 0 0 M END