IBS-ZINC04889157 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -0.6030 -1.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0940 0.0720 -1.9330 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6570 -2.0160 -1.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7180 -2.8850 -0.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3050 -4.2510 -0.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 -5.2630 -0.5610 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2100 -5.0360 0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0310 -6.1120 0.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1890 -5.8730 1.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5800 -4.5730 1.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8130 -3.5070 1.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6070 -3.7140 0.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8440 -2.6730 0.0660 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 -4.1570 -1.5890 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -2.8580 -1.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4350 -2.4380 -2.3180 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6560 -5.3010 -2.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6280 -5.7900 -1.0250 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2520 -4.9640 -0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5130 -6.9170 -1.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2370 -8.1220 -0.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6810 -7.4290 0.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 -6.3360 0.0840 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7420 -7.1250 0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8150 -6.7030 1.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5040 -4.4090 2.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1280 -2.5050 1.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6420 -1.4910 -2.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0440 -3.0870 -2.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2160 -4.9990 -2.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -6.1050 -2.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5650 -6.6340 -1.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2220 -7.1520 -2.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1580 -8.6610 -0.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4940 -8.7890 -1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4950 -7.0510 1.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0530 -8.1160 1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 17 2 0 0 0 0 6 7 1 0 0 0 0 6 15 2 0 0 0 0 7 8 2 0 0 0 0 7 16 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 13 2 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 25 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 M END