IBS-ZINC02129748 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 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 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 -2.0580 -0.1210 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7890 -2.4840 0.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8190 -2.5900 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3180 -3.2130 -0.8940 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8760 -2.4260 -1.4320 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2980 -3.6310 -1.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2240 -4.4100 -0.6820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2560 -4.0100 -2.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -5.4180 -2.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3920 -5.7860 -4.1980 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6840 -5.4980 -4.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2350 -5.7910 -5.6380 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5420 -6.4180 -6.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1340 -6.7340 -7.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 -7.3710 -8.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 -7.7030 -8.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4580 -7.4010 -7.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1900 -6.7580 -6.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5990 -6.4160 -5.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 -6.6850 -4.8380 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9160 -0.2570 0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9860 -0.1020 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9360 -1.8040 -2.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 -3.9910 -3.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0330 -3.3010 -3.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6520 -5.4360 -2.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -6.1270 -2.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2850 -4.9990 -3.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1670 -6.4800 -8.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8520 -7.6150 -9.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4990 -8.2020 -9.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 -7.6620 -7.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5150 -2.3720 1.1390 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4120 -2.7330 1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 44 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 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 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 44 45 1 0 0 0 0 M END