IBS-ZINC01866694 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 0 0 0 0 0999 V2000 -0.0040 2.0590 -0.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 0.8850 -0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9440 0.6710 -0.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7010 1.6340 -1.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0910 2.8240 -1.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7290 3.0260 -1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8830 3.8550 -2.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0420 3.6350 -2.4850 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3220 5.0400 -2.5000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0540 1.4210 -1.2980 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7160 0.2420 -0.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1700 0.2460 -1.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7120 -0.3200 -2.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0380 -0.1000 -2.2380 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3560 0.5680 -1.1840 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1890 0.8160 -0.4480 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0960 1.5150 0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2140 2.1260 1.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7440 2.6890 2.5640 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3440 2.4760 2.5900 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0020 1.7390 1.4300 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5470 2.1100 1.0900 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9680 -1.0510 -3.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7640 -1.1900 -3.1960 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6230 -1.5640 -4.3520 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9160 -2.2580 -5.3430 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5590 -2.8780 -6.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9990 -3.1560 -6.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5820 -3.1700 -4.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9280 -3.4300 -4.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7060 -3.6770 -5.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1310 -3.6640 -7.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7850 -3.4110 -7.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0330 -3.9320 -5.7160 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0580 2.2150 -0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 0.1340 0.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4080 -0.2460 -0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2530 3.9390 -1.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3970 5.2160 -2.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8420 5.7180 -2.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5600 2.0530 -1.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6340 0.2630 0.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2380 -0.6600 -1.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8040 1.6640 0.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2210 2.5430 1.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5830 -1.4530 -4.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0390 -3.1920 -7.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9780 -2.9770 -3.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3790 -3.4410 -3.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7400 -3.8570 -7.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3380 -3.4050 -8.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2440 -4.8700 -5.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 35 1 0 0 0 0 2 3 2 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 23 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 21 2 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 48 1 0 0 0 0 30 31 1 0 0 0 0 30 49 1 0 0 0 0 31 32 2 0 0 0 0 31 34 1 0 0 0 0 32 33 1 0 0 0 0 32 50 1 0 0 0 0 33 51 1 0 0 0 0 34 52 1 0 0 0 0 M END