IBS-ZINC04085056 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 44 0 0 1 0 0 0 0 0999 V2000 1.1330 0.7930 0.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3040 -0.3300 0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 -1.0140 -1.0850 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0150 -1.2580 -0.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 -0.0620 -2.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 -2.3440 -1.4680 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1480 -2.9510 -0.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1100 -2.1280 -2.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1340 -2.3870 -3.3730 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 -3.1480 -2.3650 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2860 -3.8140 -1.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7330 -3.8380 -0.8490 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9470 -4.5190 -3.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2230 -5.2390 -2.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9360 -5.8510 -3.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8430 -7.1620 -4.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6390 -7.3150 -5.4180 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7550 -8.1750 -5.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2620 -6.1280 -5.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8390 -5.1880 -4.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3310 -3.8690 -4.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2240 -3.5410 -5.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6300 -4.5030 -6.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1560 -5.8170 -6.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1270 0.4370 1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2510 1.6300 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 1.1770 1.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 -1.0750 0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6690 0.0800 -0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7610 0.7890 -2.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5590 -0.5660 -3.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1390 0.3340 -2.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7800 -3.1810 -3.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2320 -5.2320 -3.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1670 -3.7690 -3.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8990 -4.5420 -2.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9810 -6.0180 -1.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2710 -7.9940 -3.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0170 -3.1120 -4.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6010 -2.5240 -5.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3240 -4.2280 -7.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4710 -6.5630 -7.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0380 -1.7530 -1.3610 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 8 9 2 0 0 0 0 8 43 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 42 1 0 0 0 0 M CHG 1 43 -1 M END