IBS-ZINC04089765 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 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 0 0 0 0 0 0 0 0 0 0 0.7060 -0.4920 1.1800 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0380 -0.2640 1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7220 -0.1410 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0310 -0.2470 -1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6250 -0.1400 -2.2380 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 -0.4710 -1.1630 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2080 0.1070 0.0530 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5480 0.2470 1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9250 -1.0720 -0.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9440 -0.9380 -1.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3690 -2.2700 -1.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3640 -2.7470 -2.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4910 -4.1100 -2.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6780 -4.9830 -2.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6860 -4.5380 -1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5330 -3.1600 -1.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6740 -2.3990 -0.3430 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9900 -2.7480 0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4780 0.3960 -1.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9640 1.4700 -0.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9250 2.5070 -0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6830 -0.1580 2.3920 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4310 -0.5390 0.0000 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 8.0030 -2.0750 -3.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2490 -4.5150 -3.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8230 -6.0460 -2.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0580 -5.2290 -0.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5680 0.3800 -1.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1230 0.6090 -2.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4690 1.3640 0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1690 2.4580 -1.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3280 2.6380 0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8430 2.3920 -0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1670 3.3810 -0.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1510 -0.2520 3.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9520 -0.1800 -0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -1.6290 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9510 -0.1890 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5160 1.3100 -0.7380 N 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 8 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 44 1 0 0 0 0 11 12 2 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 16 17 2 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 21 33 1 0 0 0 0 21 34 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 22 44 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 23 44 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 M END