IFLAB-ZINC04315229 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7410 -0.5130 1.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0650 -0.1840 2.4310 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4880 -0.5600 2.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1180 -0.0490 1.1260 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1410 1.0410 1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.5000 0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5450 -0.5880 1.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4840 0.4420 3.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6580 0.7430 3.4760 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3630 0.7680 4.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3690 1.9870 6.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5030 2.8050 7.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6010 1.9080 8.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4220 1.3170 7.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4940 0.5410 6.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4990 2.7230 9.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5610 3.4600 8.7870 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8670 3.5520 7.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1210 4.0530 9.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2010 4.9010 10.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5050 5.3260 11.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7380 4.9120 12.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6720 4.0780 12.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3450 3.6350 10.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3700 2.8280 10.5020 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8720 -1.5930 1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7150 -0.0280 1.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5810 -1.6440 2.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9900 -0.1060 3.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1370 -0.2470 1.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9920 -0.2240 0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5210 -1.6780 0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1810 1.4230 4.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7680 -0.1530 5.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8350 1.1670 7.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1440 2.6260 6.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9580 3.6340 7.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 3.1950 8.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 1.1010 8.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9080 2.1220 6.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1790 0.6430 7.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0740 0.1310 5.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 -0.2720 6.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8010 5.2260 9.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3450 5.9850 11.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9880 5.2530 13.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0820 3.7610 13.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4620 1.4440 5.7050 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 13 54 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 14 54 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 18 54 1 0 0 0 0 19 20 1 0 0 0 0 19 28 2 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 25 26 2 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 28 1 0 0 0 0 M END