ASINEX-ZINC04103378 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 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 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -2.0270 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4250 -2.5000 -2.4700 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7830 -2.7570 -2.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9740 -3.1820 -3.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7850 -3.1740 -4.5190 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8530 -2.7770 -3.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 -2.6260 -4.0460 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 -3.1530 -5.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2600 -3.1020 -6.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1740 -2.7440 -5.6110 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4990 -3.4540 -7.6020 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8130 -3.4510 -8.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6040 -3.9500 -9.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2740 -4.7430 -9.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4840 -3.8990 -8.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2540 -3.5110 -4.3300 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2870 -3.4170 -3.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4040 -3.7100 -3.8520 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1130 -3.0070 -2.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8900 -2.6730 -1.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7460 -2.3040 -0.5900 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2690 -2.9220 -1.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4850 -3.9620 -5.7050 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 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -2.3880 -0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -2.4050 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2160 -2.4870 -6.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 -4.1720 -5.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4940 -4.1190 -7.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2190 -2.4390 -8.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4210 -4.6030 -10.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5030 -3.1100 -10.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4480 -5.7550 -9.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7590 -4.7620 -10.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -3.0400 -9.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7300 -4.5120 -8.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1680 -3.2270 -1.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3840 -1.8950 -0.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1160 -3.5800 -0.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6970 -3.1010 -6.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3330 -4.6460 -5.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5960 -4.4740 -6.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 2 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 19 1 0 0 0 0 8 9 2 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 36 1 0 0 0 0 11 37 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 18 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 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 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 26 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 23 24 2 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 M END