IFLAB-ZINC04940474 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 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 0.6710 -0.4650 -1.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -1.8110 -1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2490 -2.6690 -0.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3570 -4.0370 -0.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 -4.5530 -1.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5210 -3.7040 -2.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4110 -2.3300 -2.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9430 -1.4660 -3.4310 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2700 -0.9780 -4.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1770 -0.1550 -5.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7500 0.4730 -6.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4980 0.2660 -6.8140 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3230 -0.5170 -6.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 -1.1310 -5.0150 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7040 -0.7150 -6.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5910 -1.5330 -5.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8750 -1.7140 -6.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2860 -1.0860 -7.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4150 -0.2720 -8.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1240 -0.0760 -7.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2690 0.7280 -8.4880 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7680 1.3470 -9.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6650 1.3500 -7.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8020 1.5300 -6.7760 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2370 1.9490 -8.2940 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3620 -0.1760 -4.5160 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1750 0.3000 -4.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1940 -0.9660 -3.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0450 -1.1960 -2.6000 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 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 -0.2470 -2.2690 0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 -4.7040 0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0740 -5.6220 -1.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0170 -4.1100 -3.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2740 -2.0260 -5.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5620 -2.3490 -5.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2930 -1.2320 -7.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7420 0.2150 -9.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0750 0.5780 -10.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6240 1.9740 -9.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9850 1.9610 -10.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3290 1.8060 -8.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8360 2.5240 -8.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 25 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 30 31 2 0 0 0 0 M END