IFLAB-ZINC04163645 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 37 0 0 0 0 0 0 0 0999 V2000 -0.2490 1.9250 0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 0.4370 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -0.4840 1.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1610 -1.8040 0.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3520 -3.1040 0.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3540 -4.1500 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1690 -3.9110 -1.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 -2.6280 -1.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -1.5590 -0.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1940 -0.1980 -1.1500 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3460 0.2400 -2.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 -0.2070 2.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7290 -0.2650 3.1980 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5760 0.1470 3.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5260 0.3000 2.2910 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7280 0.2970 4.3620 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9980 0.5230 4.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1450 1.3180 6.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4020 1.5380 6.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5140 0.9700 5.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3720 0.1780 4.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1160 -0.0520 4.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7700 -0.5330 4.0960 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 2.3790 0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8240 2.3510 -0.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7610 2.1220 1.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4960 -3.2920 1.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 -5.1610 0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1740 -4.7380 -2.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1620 -2.4530 -2.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9560 0.2490 4.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2780 1.7620 6.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5160 2.1560 7.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4950 1.1440 6.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0050 -0.6730 3.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 12 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 27 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 2 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 31 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 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 20 21 2 0 0 0 0 20 34 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 35 1 0 0 0 0 M END