ASINEX-ZINC04558711 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 47 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 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -1.9980 0.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5710 -2.6880 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6300 -2.0960 0.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5510 -4.1950 0.0040 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0240 -4.5570 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8360 -4.6890 -1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7860 -6.2190 -1.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2140 -6.7730 -1.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9530 -6.1880 -0.1270 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9880 -4.7260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7300 -7.1590 0.9660 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.7520 -6.3640 1.5530 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9870 -8.3880 0.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5820 -7.5210 2.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4970 -6.6940 3.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5960 -6.9780 4.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7790 -8.0890 4.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8640 -8.9160 3.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7680 -8.6350 2.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7960 -8.3980 5.3700 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 0.5120 -0.3560 -0.8950 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 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5670 -2.4720 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3770 -4.3480 -2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8210 -4.2930 -1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 -6.5690 -2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2660 -6.5620 -0.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7060 -6.5060 -2.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1860 -7.8570 -1.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4700 -4.4600 0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5430 -4.2930 -0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1350 -5.8260 3.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5300 -6.3310 5.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2260 -9.7840 3.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8380 -9.2840 1.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2720 -9.0370 6.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 -8.9110 4.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4740 -7.4690 5.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 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 1 0 0 0 0 12 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 M END