IBS-ZINC02221781 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7000 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0810 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7710 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0680 -1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6880 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.1720 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5710 -4.9710 -0.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2860 -6.2890 -0.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5350 -6.2380 0.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 -4.9860 0.8940 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0870 -7.4270 1.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8370 -7.3840 -1.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6360 -7.0580 -2.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8760 -5.6940 -2.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5690 -5.4090 -3.7250 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3560 -4.7100 -2.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5420 -3.7880 -2.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2000 -8.0900 -3.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6480 -8.9090 -3.9260 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5610 -8.7910 -1.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7430 -9.2890 -1.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 -10.6030 -0.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 -11.4350 -0.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -10.9460 -0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6020 -9.6280 -0.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3510 -11.7640 0.1220 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6610 -11.1960 0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 -12.7300 -0.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1640 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6250 2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.6020 -2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.1410 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0560 -7.6990 0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2050 -7.1740 2.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4010 -8.2680 1.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5500 -8.6440 -1.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0070 -10.9860 -0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6100 -9.2460 -0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3720 -11.9540 0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6660 -10.3630 0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9440 -10.8380 -0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4340 -12.8700 0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 2 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 2 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 20 21 3 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 2 0 0 0 0 25 30 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 43 1 0 0 0 0 28 29 1 0 0 0 0 29 44 1 0 0 0 0 29 45 1 0 0 0 0 29 46 1 0 0 0 0 30 47 1 0 0 0 0 M END