IFLAB-ZINC04374969 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 0 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 0 0 0 0 0 0 0 0 0 0 0.6880 -0.4760 -1.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 -0.7010 -1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4210 -2.1450 -0.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9150 -3.0380 -1.7570 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -0.7110 -2.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6140 -1.1380 -3.4400 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -1.3780 -4.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4220 -1.1680 -4.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 -1.3080 -5.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5650 -0.9690 -5.0930 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3880 -0.5940 -3.7550 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0650 -0.7130 -3.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3380 -0.5050 -2.3530 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4440 -0.1510 -2.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 -1.8220 -5.6930 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0980 -2.0350 -5.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5910 -2.5170 -6.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9980 -1.6040 -7.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4500 -2.0460 -9.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4960 -3.4000 -9.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0910 -4.3130 -8.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6420 -3.8710 -7.2440 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 0.5290 -0.3650 0.8850 H 0 0 0 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 2.5450 -0.5230 -2.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5990 -0.0180 -0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4970 -2.2870 -0.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9360 -2.3490 0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0610 -3.9730 -1.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2550 -1.6390 -6.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8610 -1.0140 -2.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0270 0.5450 -2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2310 0.3460 -3.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1680 -1.9940 -6.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5930 -1.0970 -5.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3250 -2.7820 -4.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9620 -0.5460 -7.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7670 -1.3340 -9.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8490 -3.7460 -10.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1260 -5.3710 -8.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3290 -4.5840 -6.4960 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 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 15 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 14 2 0 0 0 0 11 12 2 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 46 1 0 0 0 0 M END