IFLAB-ZINC04192492 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 0.3820 1.6980 -0.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 0.2540 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 -0.4540 -1.2120 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3400 -1.7750 -1.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 -2.3340 0.0700 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7400 -2.4170 -2.1780 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0010 -3.8530 -2.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3840 -4.1660 -2.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2900 -2.0480 -4.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9140 -1.7470 -3.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8320 -4.0100 -4.8180 C 0 0 3 0 0 0 0 0 0 0 0 0 5.5740 -4.0430 -4.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3090 -3.1020 -5.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -3.0560 -7.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1380 -2.2170 -8.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2600 -1.4000 -7.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7750 -0.5460 -8.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8910 0.2350 -8.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4550 0.1390 -7.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9880 -0.6700 -6.4530 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9100 -1.4230 -6.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4180 -2.2680 -5.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0650 -2.2660 -4.5390 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6410 -5.4420 -5.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7260 -6.2910 -5.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4790 -7.5720 -6.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1720 -7.9640 -6.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1520 -7.0550 -6.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3490 -5.8030 -5.5780 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2970 2.1530 -0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3710 1.7570 -1.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 2.2810 0.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 0.2090 0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2960 -0.1950 0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9210 -4.2610 -1.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -4.3280 -2.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1790 -3.7370 -2.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5260 -5.2470 -2.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3210 -1.6540 -5.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0990 -1.6170 -3.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1210 -2.1170 -4.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -0.6650 -3.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7970 -3.6790 -7.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6280 -2.2070 -9.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3150 -0.4860 -9.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3090 0.9000 -9.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3280 0.7290 -7.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8050 -1.6280 -4.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7430 -5.9720 -5.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3020 -8.2610 -6.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9570 -8.9560 -6.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1170 -7.3180 -6.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5240 -3.5460 -4.1320 N 0 3 0 0 0 0 0 0 0 0 0 0 2.8020 -3.9940 -4.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 8 53 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 9 53 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 24 1 0 0 0 0 11 53 1 0 0 0 0 13 14 1 0 0 0 0 13 22 2 0 0 0 0 14 15 2 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END