CHEMBRIDGE-ZINC04841142 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 51 0 0 1 0 0 0 0 0999 V2000 0.0890 2.2780 1.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 0.7870 1.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0800 0.1790 0.4600 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3550 0.7400 -0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8580 -1.2980 0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0690 0.3040 1.4870 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4030 0.3150 1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9210 0.2020 -0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3020 0.2290 -0.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1730 0.3660 0.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6700 0.4760 2.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2890 0.4550 2.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7000 0.5420 3.4870 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5070 0.9570 4.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5500 1.1740 5.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1370 1.8130 6.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 2.6500 5.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5110 4.3180 4.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7190 3.5190 5.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8270 4.8550 5.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0340 2.6780 1.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1720 2.8270 0.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6830 2.4700 2.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0380 0.6330 0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5060 0.2870 1.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5820 -1.8570 1.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7700 -1.7630 -0.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 -1.4250 -0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2850 0.0830 -1.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6980 0.1370 -1.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2470 0.3800 0.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3820 0.5620 2.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0360 1.8880 4.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2300 0.1760 4.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0290 1.6470 6.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1220 0.2110 6.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8970 0.7460 6.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3800 2.0830 7.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8950 2.4950 6.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2980 2.2790 4.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3290 4.0610 3.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7720 5.3830 4.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0090 3.8340 6.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5670 3.6380 4.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0860 4.5650 3.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7110 4.7190 5.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5970 5.9260 5.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3830 2.0410 5.3140 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.1710 1.7210 4.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3020 4.0840 5.5440 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 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 26 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 16 48 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 17 50 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 18 50 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 19 48 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 20 50 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 48 1 M END