IBS-ZINC02160990 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 52 0 0 1 0 0 0 0 0999 V2000 0.1360 -0.6750 2.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2510 -0.1920 0.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 -0.6060 -0.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6430 -0.7410 0.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1880 -0.2700 -1.0590 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5490 -0.7380 -1.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5990 -0.8350 -1.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6170 -0.1480 -1.3010 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6000 -2.1890 -1.5830 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7860 -3.0170 -1.8840 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.6460 -2.5840 -1.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0540 -3.0900 -3.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3150 -3.9020 -3.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1990 -1.7030 -4.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5170 -4.4700 -1.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2840 -4.7840 -1.3550 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1970 1.1860 -1.3060 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7660 1.6060 -2.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3830 0.8510 -3.4630 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7780 3.0510 -2.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3530 3.5570 -4.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3770 4.9330 -4.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8230 5.7980 -3.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2460 5.2890 -2.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2210 3.9120 -1.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6490 3.3950 -0.6320 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9820 4.0110 0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6660 2.0580 -0.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0750 1.7240 0.7870 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1070 -0.2650 2.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6030 -0.3510 2.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 -1.7670 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2860 0.9030 0.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -1.6950 -0.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 -0.1670 -1.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8140 -0.2640 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5950 -1.8390 0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3590 -0.5040 1.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7450 -2.7470 -1.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2030 -3.5860 -3.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1870 -3.5120 -3.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5350 -3.8670 -4.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1930 -4.9580 -3.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2650 -1.1360 -3.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4490 -1.7900 -5.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9910 -1.1230 -3.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0040 2.8880 -4.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0490 5.3310 -5.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8410 6.8700 -3.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5930 5.9750 -1.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5260 -5.1270 -0.9880 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 17 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 15 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 40 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 16 2 0 0 0 0 15 51 1 0 0 0 0 17 18 1 0 0 0 0 17 28 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 2 0 0 0 0 M CHG 1 51 -1 M END