IBS-ZINC02338989 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 62 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 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -2.0270 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4250 -2.5000 -2.4700 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8640 -2.7640 -2.5840 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4280 -1.8520 -2.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0990 -3.2270 -3.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9870 -3.6520 -4.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2730 -3.8830 -6.0730 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6490 -4.1960 -6.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 -3.6240 -5.8720 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8370 -3.2180 -4.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8370 -2.7670 -3.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 -2.6500 -3.8730 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4440 -3.8300 -4.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3410 -3.0330 -5.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7000 -3.2020 -5.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1760 -4.1620 -4.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2960 -4.9570 -3.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9300 -4.7940 -3.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0640 -5.5710 -3.1580 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2710 -3.8400 -1.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4660 -3.7310 -0.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8440 -4.7190 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0210 -5.8190 0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8200 -5.9240 -0.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4460 -4.9290 -1.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0110 -6.9980 -0.3120 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7920 -7.0400 -1.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3890 -6.7910 1.0590 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9700 -6.6310 2.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0200 -4.6120 0.6470 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8170 -3.4550 0.3830 C 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 0.5290 -0.3650 0.8850 H 0 0 0 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 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -2.3880 -0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -2.4050 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9730 -2.2840 -6.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3940 -2.5850 -5.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2410 -4.2890 -4.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6750 -5.7040 -3.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8220 -6.3930 -3.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1050 -2.8760 -1.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5120 -5.0080 -1.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1870 -6.1680 -0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0190 -7.0380 -2.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2430 -7.9470 -0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3800 -5.7040 2.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8810 -6.5960 2.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3290 -7.4730 3.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2500 -2.5580 0.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7250 -3.4940 0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0820 -3.4300 -0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 38 1 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 3 40 1 0 0 0 0 3 41 1 0 0 0 0 4 5 1 0 0 0 0 4 42 1 0 0 0 0 4 43 1 0 0 0 0 5 6 1 0 0 0 0 5 14 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 23 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 33 1 0 0 0 0 26 27 2 0 0 0 0 26 31 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 31 32 1 0 0 0 0 32 54 1 0 0 0 0 32 55 1 0 0 0 0 32 56 1 0 0 0 0 33 34 1 0 0 0 0 34 57 1 0 0 0 0 34 58 1 0 0 0 0 34 59 1 0 0 0 0 M END