IFLAB-ZINC04088087 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 -0.1660 1.4920 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1960 -0.0320 0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 -0.4390 1.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6440 -0.5210 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5630 -0.6340 -1.0380 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8820 -0.3850 -1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6440 0.7340 -0.1150 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6000 -1.0170 -2.1120 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9490 -1.8970 -3.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1210 -1.3050 -4.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5170 -0.8920 -4.6790 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1530 -0.6590 -5.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4240 -0.2910 -5.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5790 -0.3010 -4.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 -0.6740 -3.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0620 -0.8420 -2.2000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3640 0.0450 -1.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7600 -2.0590 -1.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6110 -3.2830 -2.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2500 -4.4000 -1.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0400 -4.2920 -0.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1900 -3.0670 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5540 -1.9500 -0.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8440 -5.6940 -0.0060 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.8540 1.8490 0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 1.7760 -1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8120 1.9360 0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1940 -0.0840 2.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5110 -1.5250 1.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4250 0.0020 1.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0910 -0.2310 -0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6660 -1.6060 0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2090 -0.0730 0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 -1.2120 -1.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4080 -2.8860 -3.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8870 -1.9790 -2.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8630 -2.0560 -5.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4680 -0.4400 -4.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7170 -0.7520 -6.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1820 -0.0360 -6.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4770 -0.0540 -3.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9940 -3.3670 -3.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1330 -5.3560 -2.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8060 -2.9830 0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6740 -0.9930 -0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 14 15 2 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 M END