IFLAB-ZINC04374966 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -1.9690 1.1740 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5040 -2.6570 2.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9940 -1.9710 3.2180 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6140 -2.5840 4.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7440 -3.9860 4.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3190 -4.9570 5.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1510 -6.1300 4.4790 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4660 -5.9950 3.2640 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2090 -4.6720 3.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5980 -3.9730 2.1080 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0910 -7.0890 2.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1210 -1.8630 5.2820 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9780 -0.4050 5.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6110 0.1340 6.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9450 0.4980 6.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5260 0.9930 7.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7740 1.1250 8.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4400 0.7630 8.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8570 0.2720 7.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.4990 0.0120 O 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 1.7350 -0.0630 1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 -0.2350 2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 -2.4520 0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8160 -4.7610 5.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1020 -7.4580 2.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0740 -6.7240 1.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8170 -7.8970 2.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5720 -2.3220 6.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4710 0.0270 4.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9200 -0.1440 5.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5330 0.3940 5.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5690 1.2760 7.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2280 1.5120 9.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8520 0.8670 9.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8140 -0.0070 7.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8530 -0.2240 0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 24 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 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 14 2 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 9 13 2 0 0 0 0 10 11 2 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 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 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 M END