IFLAB-ZINC04087184 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 0 0 0 0 0999 V2000 0.9930 0.5760 1.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 -0.0040 0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4160 -0.3770 -2.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3310 -0.2220 -3.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6300 -0.9530 -3.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0610 -1.3430 -2.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5500 -2.1450 -2.2440 S 0 0 0 0 0 0 0 0 0 0 0 0 4.6910 -1.9360 -3.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5710 -1.3210 -4.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3920 -1.0280 -5.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8750 0.0070 -6.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7950 -2.0140 -6.7570 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8530 -2.2910 -4.5980 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9490 -2.9690 -4.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0410 -3.4940 -2.9720 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1030 -3.0790 -5.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4440 -1.7690 -5.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1900 -1.6620 -7.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4090 -0.4650 -7.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8920 0.6410 -7.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1760 0.5650 -5.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9620 -0.6500 -5.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2760 -0.6710 -3.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7690 0.4590 -3.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9660 1.6400 -3.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6730 1.6920 -5.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3210 -1.1200 -0.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7590 -0.1060 1.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4690 1.5310 1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2830 0.7530 2.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1310 -1.0030 0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 0.6620 -0.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4070 0.3440 -2.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -1.3910 -2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8010 -0.5890 -4.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5480 0.8410 -3.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1300 -2.9200 -6.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7230 -1.8400 -7.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9030 -2.0000 -5.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9920 -3.4560 -4.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8280 -3.8450 -5.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8180 -2.5140 -7.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2060 -0.3910 -8.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0540 1.5680 -7.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1490 -1.5750 -3.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9970 0.4100 -1.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3550 2.5190 -3.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8410 2.6250 -5.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8610 -2.0510 -0.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9840 -0.7160 -0.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1910 -0.1030 -1.1040 N 0 3 0 0 0 0 0 0 0 0 0 0 1.6460 0.8120 -1.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 51 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 51 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 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 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 51 1 M END