IBS-ZINC02133919 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 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 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 -0.4920 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2820 -0.8810 2.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9940 -1.3680 3.3380 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4760 -1.0220 4.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0110 -2.8740 3.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 -3.5860 2.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1070 -4.9720 2.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9570 -5.6530 3.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 -4.9390 3.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8540 -3.5520 3.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2530 -2.8510 4.0590 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1740 -2.5070 3.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1670 -5.8260 4.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4970 -7.0860 4.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6800 -6.9870 3.4010 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4140 -2.8940 2.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1340 -1.4280 2.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3580 0.6270 3.2510 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 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 3.9880 -5.5250 2.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5450 -3.4160 2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0090 -1.9510 3.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6690 -1.8910 2.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7650 -7.2100 5.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1320 -7.9110 3.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1260 -2.9480 3.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8360 -3.3880 1.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0760 -0.8920 2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5610 -1.3650 1.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8260 1.0400 4.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8620 0.9370 2.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3850 0.9940 3.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5880 -0.1670 -1.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3610 -0.8390 3.3350 N 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 4 1 0 0 0 0 2 22 1 0 0 0 0 4 5 3 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 40 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 19 1 0 0 0 0 10 11 1 0 0 0 0 10 26 1 0 0 0 0 11 12 2 0 0 0 0 11 18 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 27 1 0 0 0 0 15 28 1 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 30 1 0 0 0 0 17 31 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 19 33 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 20 40 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 21 40 1 0 0 0 0 22 39 1 0 0 0 0 M END