ASINEX-ZINC04114925 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 58 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 0.7010 -0.4880 1.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7310 -1.3350 0.6830 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3530 -2.3500 0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0270 -0.6870 -0.7060 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5210 0.2740 -0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7000 -0.4770 -1.1800 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9250 -1.6070 -1.4990 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1580 -1.1510 -2.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1480 -1.8130 -0.7480 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9300 -2.3390 0.5340 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3720 -3.2690 0.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0540 -1.3610 1.3970 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4920 -0.3640 1.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1060 -2.0260 2.6620 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4850 -2.4600 2.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0190 -2.5830 1.4050 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5520 -3.8090 3.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2980 -1.4230 3.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2320 -2.9270 -1.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6810 -3.9380 -1.2210 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1120 -2.9840 -2.4660 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4380 -4.2670 -2.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 -4.0580 -3.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8120 -4.2180 -4.8950 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 -4.4810 -5.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0980 -3.9350 -5.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7340 -3.9240 -6.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0690 -3.5870 -6.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7780 -3.2600 -5.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1680 -3.2660 -4.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8160 -3.6040 -4.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9520 -3.7040 -3.1070 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 -0.5390 0.0000 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 3.9790 -4.5480 2.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5900 -4.1320 3.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1340 -3.7070 4.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8830 -1.3120 4.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3350 -1.7530 3.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2560 -0.4650 3.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7520 -2.1750 -2.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1210 -4.9580 -3.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 -4.6820 -1.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1870 -4.1770 -7.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5660 -3.5770 -7.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8240 -2.9980 -5.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7300 -3.0090 -3.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9560 -0.1690 -0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -1.6280 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9470 -0.1990 0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 14 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 21 1 0 0 0 0 11 12 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 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 42 1 0 0 0 0 20 43 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 34 2 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 48 1 0 0 0 0 30 31 1 0 0 0 0 30 49 1 0 0 0 0 31 32 2 0 0 0 0 31 50 1 0 0 0 0 32 33 1 0 0 0 0 32 51 1 0 0 0 0 33 34 1 0 0 0 0 35 52 1 0 0 0 0 35 53 1 0 0 0 0 35 54 1 0 0 0 0 M END