ASINEX-ZINC04993196 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 0 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 0.6880 -0.4760 -1.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0460 -0.7340 -1.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2370 -1.1590 -2.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0480 -1.1510 -3.2510 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 -0.7540 -2.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5990 -0.6020 -2.7790 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.5930 -1.1290 -4.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0180 -1.0780 -5.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3120 -1.2460 -7.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2250 -1.5680 -8.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8330 -3.0370 -8.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5010 -3.2920 -8.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6370 -2.9200 -6.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5170 -1.4880 -3.0630 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5500 -1.3940 -2.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6670 -1.6870 -2.5850 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3760 -0.9840 -0.9360 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1530 -0.6500 -0.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0090 -0.2810 0.6780 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5320 -0.8980 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7480 -1.9390 -4.4380 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 0.5290 -0.3650 0.8850 H 0 0 0 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 -0.9530 -0.4640 -5.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2130 -2.1490 -4.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6580 -1.7430 -4.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3980 -0.0580 -4.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5770 -0.1970 -6.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0730 -1.8740 -6.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1940 -1.3900 -9.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4740 -0.9310 -9.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6040 -3.6750 -8.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7280 -3.2590 -9.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2380 -4.3460 -8.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7220 -2.6820 -8.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4070 -3.5400 -6.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6860 -3.0870 -6.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4310 -1.2040 -0.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6480 0.1280 0.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3790 -1.5560 0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9600 -1.0780 -5.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5960 -2.6230 -4.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8590 -2.4510 -4.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0130 -1.5060 -6.4700 N 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 7 1 0 0 0 0 4 5 2 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 16 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 10 49 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 11 49 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 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 41 1 0 0 0 0 15 42 1 0 0 0 0 15 49 1 0 0 0 0 16 17 1 0 0 0 0 16 23 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 2 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 M END