ASINEX-ZINC04999061 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 0.3410 1.3470 0.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 -0.0890 0.1120 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 -1.0010 1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 -0.5710 -1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 0.1660 -2.0880 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4310 -1.8700 -1.2910 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6820 -2.8630 -0.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6530 -3.8690 -0.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3520 -3.8140 -2.3180 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6030 -2.5780 -2.5660 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3730 -2.8220 -2.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3640 -1.7070 -3.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5980 -1.1940 -3.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2960 -0.3950 -4.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7600 -0.1080 -5.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5260 -0.6190 -5.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8260 -1.4150 -4.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7880 -4.9400 -3.4520 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 -4.7150 -4.5810 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8580 -6.1860 -2.7740 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4300 -4.5570 -3.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6400 -3.7960 -5.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9270 -3.4950 -5.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0080 -3.9560 -4.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7950 -4.7190 -3.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5060 -5.0230 -3.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2750 -3.6610 -5.1590 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3400 -4.1690 -4.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 1.5730 0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2180 1.9040 -0.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 1.6320 1.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 -1.1750 1.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6170 -1.9490 0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7790 -0.5590 2.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2460 -3.3580 0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1460 -2.3880 0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4720 -4.8720 -0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6850 -3.5720 -0.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0160 -1.4190 -2.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2600 0.0040 -3.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3050 0.5160 -5.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1070 -0.3950 -6.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 -1.8120 -5.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7970 -3.4370 -5.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0900 -2.9000 -6.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6360 -5.0800 -3.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3400 -5.6210 -2.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2880 -5.2580 -4.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2490 -3.7760 -3.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2960 -3.8620 -4.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 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 10 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 M END