IFLAB-ZINC04136100 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 55 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2060 -0.6900 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4040 0.0150 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3840 1.4210 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 2.0950 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6610 2.1690 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6560 3.3840 -0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9390 1.4350 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3420 1.8660 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9790 3.1070 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3410 3.1700 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1050 2.0000 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4890 0.7630 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1000 0.6810 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2460 -0.3600 -0.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9630 0.0550 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6970 -0.7020 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7170 -1.9170 -0.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3030 -0.5060 -0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2080 0.9330 0.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4610 2.1010 -0.0950 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5410 -1.3870 -0.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8860 -1.1200 -1.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7850 -2.3490 -0.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0730 -2.0930 -1.5480 N 0 0 0 0 0 0 0 0 0 0 0 0 16.1830 -1.5460 -0.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1360 -1.4910 -1.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6220 -1.9920 -3.0470 N 0 0 0 0 0 0 0 0 0 0 0 0 15.3880 -2.3600 -2.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9020 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -0.5530 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 -1.7700 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1490 3.1750 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3950 4.0160 -0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8340 4.1310 -0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3190 -0.9360 0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8540 -1.2180 -0.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2590 1.0830 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1100 0.7380 1.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0620 -2.2480 -0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7020 -1.5910 0.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7240 -0.9160 -2.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3640 -0.2600 -0.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9470 -2.5530 0.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3070 -3.2090 -1.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2770 -1.2190 0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1390 -1.1100 -1.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7280 -2.8020 -3.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6770 -0.2080 -0.5130 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 18 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 17 2 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 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 13 14 2 0 0 0 0 13 22 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 20 50 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 21 50 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 30 1 0 0 0 0 27 28 2 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 29 30 2 0 0 0 0 30 49 1 0 0 0 0 M END