NCID-ZINC04621596 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 0.1020 1.2350 -0.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -0.1340 -0.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3030 -0.8280 -0.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5120 -0.1400 -0.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5210 1.2280 -0.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3140 1.9280 -0.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3200 3.3960 -0.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2700 4.0030 -0.9520 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4900 4.0630 -0.9280 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4960 5.5200 -1.0790 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6480 5.9440 -0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7980 6.0860 -0.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8440 5.8350 1.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1250 6.3930 1.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9200 6.9360 0.8350 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 5.8740 -2.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3220 5.0000 -3.3700 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2970 -2.2110 -0.2960 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5630 -2.9430 -0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2770 -4.4390 -0.0530 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7940 -4.8140 -0.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5910 -5.1970 0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1670 -4.7350 1.4570 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3440 -4.6140 2.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9660 -4.5740 2.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 -4.4480 3.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 -4.4100 3.4220 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7370 -4.3700 4.7450 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1910 -4.2810 5.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0930 -4.4160 4.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -4.5340 3.7940 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6680 -4.3370 6.0950 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4020 -4.6630 1.1090 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -4.9480 0.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5680 -5.3320 1.8880 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4770 -4.8060 -0.2690 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8320 1.7730 -0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8370 -0.6700 -0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4440 -0.6820 -0.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4600 1.7610 -0.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3280 3.5780 -0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6470 5.5970 -0.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8420 7.1590 -0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9940 6.3250 1.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7990 4.7630 1.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4550 -2.6910 -0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1470 -2.7750 -1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1240 -2.5920 0.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3930 -6.2670 0.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2860 -4.9920 -0.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1100 -4.5180 1.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1100 -4.2490 6.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6330 -4.3680 6.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -4.5690 -1.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 -4.9410 -0.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3840 6.2870 2.8780 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 7.1620 -2.9190 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3140 7.3400 -3.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2190 6.6600 3.1920 H 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 37 1 0 0 0 0 2 3 2 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 4 5 2 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 6 7 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 41 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 15 2 0 0 0 0 14 56 1 0 0 0 0 16 17 2 0 0 0 0 16 57 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 33 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 24 25 2 0 0 0 0 24 31 1 0 0 0 0 25 26 1 0 0 0 0 25 33 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 52 1 0 0 0 0 32 53 1 0 0 0 0 33 34 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 36 54 1 0 0 0 0 36 55 1 0 0 0 0 56 59 1 0 0 0 0 57 58 1 0 0 0 0 M END