CHEMDIV-ZINC06950117 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 0 0 0 0 0 0999 V2000 -0.1660 0.7570 1.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4190 -0.6960 0.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -1.6600 2.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8730 -0.9240 0.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2040 -1.2800 -0.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5330 -1.4900 -1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5420 -1.3590 -0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2390 -0.9780 1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9080 -0.7690 1.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2360 -1.5940 -0.6610 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.0580 -0.8480 0.2700 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3270 -1.3570 -2.0870 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4900 -3.2670 -0.3770 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4920 -3.7190 1.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1560 -5.1000 1.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4310 -5.6140 -1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7820 -4.2250 -1.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9770 -7.5260 0.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2550 -8.1840 1.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2450 -7.6340 2.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7490 -9.4530 2.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2530 -9.7810 3.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6580 -10.9500 4.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5600 -11.8020 3.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0530 -11.4900 2.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6510 -10.3190 1.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0780 -9.9710 0.2690 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9260 -10.8840 -0.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9010 0.9240 1.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4790 1.4470 0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7090 1.0270 2.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2050 -0.8960 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1330 -2.7010 1.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1110 -1.5410 2.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4900 -1.4890 2.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4240 -1.3830 -1.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7640 -1.7470 -2.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0220 -0.8350 1.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6820 -0.4700 2.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4640 -3.7680 1.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0570 -3.0160 1.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0910 -5.4800 2.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2040 -5.0660 0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4710 -5.5980 -1.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8570 -6.3410 -1.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8400 -3.8840 -2.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7260 -4.2880 -0.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7260 -8.0550 -0.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0560 -7.4540 0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5430 -9.1300 3.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2690 -11.1960 5.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8790 -12.7150 3.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7510 -12.1930 1.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8830 -11.0020 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1340 -10.4610 -1.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4300 -11.8490 -0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4450 -6.0940 0.2500 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.4690 -6.1620 0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 15 57 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 16 57 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 18 57 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 24 25 2 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 57 1 M END