IFLAB-ZINC04357540 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 52 0 0 1 0 0 0 0 0999 V2000 -0.0520 1.5430 0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 0.0130 0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4600 -0.5210 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4350 -2.0500 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8080 -2.5620 0.0630 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0320 -3.8910 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0960 -4.6640 0.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4320 -4.4120 0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3680 -3.6390 0.0510 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6560 -5.7410 0.0380 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0290 -6.2520 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0040 -7.7820 0.0200 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.0190 -8.1660 0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1810 -8.2700 1.1370 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8540 -9.7030 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2930 -10.1160 -0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2660 -9.6620 -1.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4340 -8.2440 -1.2080 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6360 -7.2320 2.3080 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.2190 -7.3290 2.3020 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3330 -6.0090 2.1150 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1720 -7.8700 3.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3700 -8.7530 4.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7900 -9.2530 5.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0130 -8.8710 6.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8160 -7.9870 5.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3920 -7.4830 4.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5410 -9.5000 7.8260 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.9690 1.9230 0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 1.9040 -0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 1.8910 0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4950 -0.3350 -0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4920 -0.3480 0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9820 -0.1720 0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9780 -0.1600 -0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9130 -2.3990 -0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9170 -2.4120 0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5550 -1.9440 0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9090 -6.3590 0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5510 -5.9040 0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5480 -5.8920 -0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1070 -9.8830 1.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7540 -10.2790 1.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3240 -9.6420 -0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1820 -11.1990 -0.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8670 -9.9370 -2.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2300 -10.1480 -1.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4150 -9.0520 4.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1630 -9.9430 6.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7710 -7.6880 6.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0170 -6.7900 3.8380 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 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 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 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 18 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 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 17 18 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 51 1 0 0 0 0 M END