ASINEX-ZINC04114924 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 58 0 0 1 0 0 0 0 0999 V2000 -0.3860 1.1730 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 -0.3370 0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3620 -0.7750 1.2390 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3720 -1.8100 1.9170 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3180 -2.7430 1.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8160 -1.2510 1.8950 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5550 -2.0440 2.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8770 -0.6470 0.5770 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0210 -0.1430 2.9250 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.0910 0.0320 3.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4630 -0.4500 4.2080 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 -0.6970 4.1070 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4090 0.1060 3.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -2.0260 3.3300 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5370 -2.7790 3.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4680 -2.3270 3.5410 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6850 -1.9410 4.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6460 -0.9540 5.3070 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0890 -1.3550 5.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5350 -3.1650 5.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3790 1.1190 2.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2080 1.3410 2.6400 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1050 2.0020 1.6970 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4920 3.2510 1.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4910 4.0280 0.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3050 5.0040 0.9010 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3440 5.3180 1.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0640 5.4670 -0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0490 6.4360 -0.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6270 6.6600 -1.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2300 5.9240 -2.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2620 4.9670 -2.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6620 4.7220 -1.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6960 3.8650 -0.8580 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1890 -1.0630 -1.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3270 1.3670 -0.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3540 1.5980 -0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 1.6290 0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1910 -0.4790 4.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2490 -1.0660 6.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8290 -2.1020 4.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 -3.9190 5.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6990 -2.8710 6.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5320 -3.5760 5.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0320 1.8110 1.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1880 3.8460 2.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6190 3.0240 0.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3620 7.0110 0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3940 7.4140 -1.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6910 6.1110 -3.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9610 4.4000 -3.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8410 -0.8410 -1.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3040 -2.1370 -0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8610 -0.7260 -1.8980 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