IFLAB-ZINC00958065 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -0.4720 -1.1930 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 -1.8080 -1.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 -2.5600 -0.5180 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4590 -2.3510 -2.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7740 -2.6610 -3.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -3.1470 -4.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2410 -3.2430 -4.1090 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8020 -2.6170 -2.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6840 -2.4080 -1.5400 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9910 -2.7020 -1.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3940 -3.1510 -2.7470 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9330 -2.4790 -0.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4720 -1.9630 0.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3540 -1.7560 1.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6950 -2.0570 1.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1630 -2.5700 0.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2850 -2.7880 -0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4820 -2.8640 0.1760 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3290 -2.6200 1.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6800 -2.4610 -3.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1370 -1.7770 -5.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4920 -1.5940 -5.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3960 -2.0890 -4.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9460 -2.7690 -3.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5940 -2.9620 -3.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0980 -1.8550 -4.6210 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 -3.4400 -5.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3620 -2.0490 -0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4260 -1.7260 0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9970 -1.3560 2.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3810 -1.8930 2.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6460 -3.1920 -1.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2920 -1.5630 1.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9880 -3.2160 2.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3530 -2.8970 1.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4330 -1.3900 -5.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8470 -1.0640 -6.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6560 -3.1520 -2.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2450 -3.4960 -2.1900 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 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 10 2 0 0 0 0 7 8 2 0 0 0 0 7 22 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 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 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 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 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 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 45 1 0 0 0 0 27 46 1 0 0 0 0 M END