IBS-ZINC04024954 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 46 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 3 0 0 0 0 0 0 0 0 0 0.5130 -0.3520 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7510 -0.5060 1.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 -1.4110 2.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1070 -1.7360 3.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0470 -1.3220 4.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9220 -1.8420 5.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 -2.7360 6.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0260 -3.1630 5.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -2.6490 3.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6750 -2.8500 2.7150 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4480 -3.4330 2.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1720 -2.1060 1.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6650 -1.9490 0.2770 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1340 -2.6110 -0.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3710 -0.5060 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5170 0.1820 -0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6430 1.2370 -0.7630 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6060 -0.6080 0.4840 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5930 -0.4410 1.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1680 -2.0960 0.1420 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4350 -2.3570 -0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8720 -3.0010 1.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3530 -2.7120 1.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8570 -1.6410 0.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0130 -0.4400 -0.0540 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 1.6390 -1.0470 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0650 0.3540 1.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8340 -0.6260 4.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6290 -1.5450 6.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1310 -3.1140 7.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8040 -3.8610 5.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6790 -4.0440 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5200 -2.7870 2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0380 -3.4470 1.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9330 -1.5520 0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4140 0.5270 0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0060 -0.5160 -1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 17 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 14 2 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 22 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 27 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 25 26 2 0 0 0 0 25 39 1 0 0 0 0 26 27 1 0 0 0 0 26 40 1 0 0 0 0 27 41 1 0 0 0 0 27 42 1 0 0 0 0 M END