IFLAB-ZINC04174738 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 0 0 0 0 0 0999 V2000 0.0960 1.3050 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 -0.0350 -0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2400 -0.6080 -0.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3360 0.1900 -1.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3140 1.5300 -0.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1940 2.1050 -0.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 3.5460 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3320 4.2390 0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5050 5.6940 0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5630 6.4620 0.2620 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7600 6.1070 0.3050 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7620 5.1760 0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0520 5.4120 0.3240 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9420 4.3720 0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0740 4.4620 -0.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9670 3.4120 -0.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7430 2.2690 0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6190 2.1750 0.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7230 3.2220 1.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6260 1.2370 0.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9840 3.5920 0.1150 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2650 -2.0560 -1.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3130 -2.7500 -0.7890 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7710 1.7480 0.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7260 -0.6520 0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2010 -0.2550 -1.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1620 2.1450 -1.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 4.0550 0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9650 7.0510 0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2490 5.3510 -1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8430 3.4810 -1.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4480 1.2830 1.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8510 3.1500 1.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3360 1.2910 0.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3440 -2.6100 -1.6740 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3140 -3.5620 -1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 21 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 12 13 2 0 0 0 0 12 21 1 0 0 0 0 13 14 1 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 30 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 20 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 19 33 1 0 0 0 0 20 34 1 0 0 0 0 22 23 2 0 0 0 0 22 35 1 0 0 0 0 35 36 1 0 0 0 0 M END