IFLAB-ZINC04939781 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 51 0 0 1 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 -1.8070 -1.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 -2.5590 -0.5180 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4600 -2.3520 -2.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 -2.6590 -3.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5950 -3.1450 -4.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2390 -3.2410 -4.1030 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8010 -2.6150 -2.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6820 -2.4040 -1.5330 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9890 -2.6970 -1.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3940 -3.1460 -2.7320 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9470 -2.4670 -0.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3580 -2.8790 -0.9690 C 0 0 3 0 0 0 0 0 0 0 0 0 7.3430 -3.9100 -1.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2930 -2.7660 0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2460 -2.0250 0.1520 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8370 -2.6620 -2.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2920 -1.7130 -3.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9520 -0.5850 -3.4070 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 -3.5540 -6.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3620 -3.7190 -6.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0050 -2.4730 -5.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7210 -2.4550 -3.9940 C 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 3.3580 -2.0440 -0.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9440 -1.4110 -0.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6400 -3.0630 0.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4130 -3.5630 -3.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6910 -2.9290 -2.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9800 -2.2360 -4.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4250 -1.3760 -4.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2680 0.0600 -4.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 -2.7830 -6.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6320 -4.4990 -6.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 -3.8360 -7.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6390 -4.5980 -5.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 -1.5800 -5.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0810 -2.4980 -5.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2740 -3.2580 -3.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 -1.4950 -3.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0660 -3.4870 1.3170 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8190 -1.9960 -2.0480 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0450 -1.6810 -2.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6940 -3.3800 2.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 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 25 1 0 0 0 0 8 9 1 0 0 0 0 8 22 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 31 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 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 48 1 0 0 0 0 17 18 2 0 0 0 0 17 47 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 47 50 1 0 0 0 0 48 49 1 0 0 0 0 M END