ASINEX-ZINC04858980 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3840 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 1.1860 -0.6850 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 0.0190 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3750 1.4240 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 2.0980 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6970 1.8220 -0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0220 2.7360 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4590 0.6950 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6980 -0.3600 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9660 0.6730 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4740 -0.1680 1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9390 -0.1910 1.1090 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6940 0.8340 1.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9510 0.3640 3.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0960 -0.3590 3.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2910 -0.7700 4.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3450 -0.4490 5.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2680 0.2400 5.4870 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0520 0.6530 4.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5920 -1.1540 0.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7100 -2.3500 -0.4200 S 0 0 0 0 0 0 0 0 0 0 0 0 9.9400 -1.1740 0.4160 N 0 0 0 0 0 0 0 0 0 0 0 0 10.6490 -2.2200 -0.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1580 -2.0150 -0.1760 C 0 0 3 0 0 0 0 0 0 0 0 0 12.4360 -2.0530 0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9150 -3.1070 -0.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7840 -2.3180 -1.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8510 -0.9160 -1.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5360 -0.7460 -0.7360 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9070 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.5510 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1900 -1.7650 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 3.1780 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3140 0.2380 -0.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3460 1.6900 0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1260 0.2660 2.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0950 -1.1860 1.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6440 1.0100 1.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1190 1.7590 1.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8180 -0.5950 2.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1710 -1.3350 5.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4890 -0.7660 6.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1610 1.2190 4.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4400 -0.4960 0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3750 -3.1970 0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3770 -2.1690 -1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5450 -3.6900 -0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2130 -3.7550 -1.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7780 -2.7570 -2.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2990 -2.2680 -2.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6140 -0.8920 -0.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0440 -0.1500 -2.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 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 18 19 2 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 30 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 M END