IFLAB-ZINC04338816 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 -1.0200 -0.3810 0.0100 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 0.7630 -2.0410 1.2330 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2600 -2.4180 1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 -2.5340 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -2.0270 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6960 -2.5570 -1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4550 -2.5210 -2.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4710 -2.5260 2.4200 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 -2.6740 3.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4600 -3.1390 4.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7820 -3.5400 5.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8430 -3.8840 6.3110 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5840 -3.7300 6.9050 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7190 -3.2690 5.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 -2.9480 5.9480 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1500 -2.5180 4.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4950 -2.3750 3.7090 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2530 -4.0160 8.3030 C 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 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5020 -2.1570 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4940 -3.6240 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2070 -2.2050 -0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2240 -2.1960 -2.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6820 -3.6470 -1.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4700 -3.6110 -2.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 -2.1600 -3.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4780 -2.1440 -2.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4150 -2.7440 2.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6040 -3.5590 4.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2010 -2.2680 4.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4090 -3.1200 8.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 -4.3240 8.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8950 -4.8170 8.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 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 26 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 12 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 21 2 0 0 0 0 14 15 1 0 0 0 0 14 18 2 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 M END