IFLAB-ZINC02715788 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 0 0 0 0 0999 V2000 -0.3680 2.1120 -0.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3250 0.5970 -0.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6510 0.0680 -0.6710 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7900 -1.2730 -0.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0480 -1.8540 -0.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1870 -3.2180 -0.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0730 -4.0040 -0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8180 -3.4280 -0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 -2.0650 -0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2530 -5.7440 0.0500 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1180 -6.1770 0.7860 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5890 -5.9580 0.4850 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1250 -6.4830 -1.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8760 -6.6490 -2.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3110 -6.2320 -1.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5040 -6.4090 -2.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5620 -6.9980 -3.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 -7.4130 -4.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8180 -7.2490 -3.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9420 -7.6510 -4.0560 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1150 -7.5080 -3.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2560 -6.9260 -2.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5930 -6.7830 -1.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3420 -5.9020 -1.9900 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0220 -7.7100 -0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2640 -7.5440 0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6570 -8.4130 1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8240 -9.4470 1.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5930 -9.6180 0.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1890 -8.7600 -0.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7760 -5.9620 -1.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 2.5160 -0.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7930 2.3310 -1.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9850 2.5690 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2920 0.1400 -1.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 0.3780 0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9190 -1.2400 -0.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1670 -3.6710 -0.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -4.0440 0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3080 -1.6160 -0.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2780 -5.7740 -0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5200 -7.1270 -3.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4960 -7.8670 -5.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9960 -7.8460 -4.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9140 -6.7360 -0.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6170 -8.2850 1.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1370 -10.1240 2.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9480 -10.4280 1.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2290 -8.8980 -0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1780 -6.7790 -0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5050 -5.6740 -2.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5660 -5.1080 -0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 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 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 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 39 1 0 0 0 0 9 40 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 22 2 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 28 29 2 0 0 0 0 28 47 1 0 0 0 0 29 30 1 0 0 0 0 29 48 1 0 0 0 0 30 49 1 0 0 0 0 31 50 1 0 0 0 0 31 51 1 0 0 0 0 31 52 1 0 0 0 0 M END