ASINEX-ZINC05008391 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 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 3 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 0.7310 -0.5030 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7250 -1.1860 1.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2780 -0.1910 2.4530 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 -0.6760 3.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2700 -0.1820 4.8990 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7570 -0.5460 4.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0130 -0.6820 6.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3890 0.6140 6.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3840 1.6380 6.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2810 1.2540 4.9360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 -0.4760 -1.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1880 -0.8750 -2.5520 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7550 -1.2570 -3.5440 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2390 -1.7230 -2.1110 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9510 0.6030 -3.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2940 1.4050 -4.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8900 2.5640 -4.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1490 2.9230 -4.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8060 2.1160 -3.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2080 0.9550 -2.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7380 4.0630 -4.4950 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0350 4.3690 -3.9790 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 -0.5170 0.3560 2.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0010 -1.7660 3.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0090 -0.2990 3.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3570 -1.3030 6.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9090 -1.2330 5.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2410 0.4940 7.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 0.9090 6.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 1.5500 6.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7720 2.6520 6.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6540 -0.5560 -1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 1.1260 -4.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3760 3.1910 -5.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7870 2.3930 -2.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7210 0.3240 -1.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7250 3.5650 -4.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9790 4.4750 -2.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3890 5.3020 -4.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 14 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 13 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 M END