IFLAB-ZINC00214869 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 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 0 0 0 0 0 0 0 0 0 0 0.6930 -0.4770 1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -1.8240 1.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4600 -2.3530 2.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5700 -3.7220 2.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 -4.5660 1.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3670 -4.0410 0.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 -2.6730 0.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 -6.0590 1.7640 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3550 -6.2650 2.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3340 -6.5230 0.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1250 -7.4450 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2730 -7.9380 -0.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5680 -7.8930 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8040 -6.4540 0.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6030 -5.9970 1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7400 -5.1620 2.0830 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8720 -7.9420 -0.2420 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2130 -7.5700 0.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7210 -8.2790 0.0550 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.1610 -6.6590 1.4370 N 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 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8880 -1.6940 3.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0820 -4.1340 3.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -4.7020 -0.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2670 -2.2640 -0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0780 -8.9630 -1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3750 -7.3020 -1.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4780 -8.5510 0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4020 -8.2150 -0.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6910 -6.4190 1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9430 -5.8040 -0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -8.6030 -0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 -6.4040 1.9210 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 26 1 0 0 0 0 2 27 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 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 22 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 39 1 0 0 0 0 M END