NIH-ZINC04040749 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 64 0 0 1 0 0 0 0 0999 V2000 -0.3200 0.8330 2.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1890 -0.4110 1.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 -1.2880 1.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3280 -2.0140 0.4210 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3550 -2.8580 0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4160 -2.9840 1.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4580 -3.8420 0.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4460 -4.5760 -0.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3900 -4.4520 -1.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3480 -3.5900 -1.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3780 -5.2530 -2.6000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6440 -4.8430 -3.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0610 -6.7000 -2.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8360 -7.2180 -1.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5390 -7.0640 -2.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6440 -7.4500 -1.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8510 -7.3050 -2.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8920 -6.7780 -3.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 -6.3930 -4.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4910 -6.5380 -3.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4160 -6.5980 -4.4860 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.8870 -7.7740 -0.6050 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1260 -7.4260 -2.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2400 -8.7720 -2.6260 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1460 -6.5160 -3.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2170 -6.8650 -3.7340 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7110 -5.2430 -3.2140 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4400 -4.0580 -3.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0940 -3.7820 -5.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7050 -2.4340 -7.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5280 -1.2220 -7.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0810 -0.0630 -6.7900 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1830 -0.1840 -5.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3570 -1.3860 -4.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5520 1.4610 2.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 1.2300 2.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7920 -0.8080 1.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4490 -1.9890 2.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3020 -0.6680 1.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4260 -2.4120 1.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2840 -3.9410 1.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2610 -5.2460 -0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5250 -3.4900 -1.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -7.8610 -0.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7660 -7.6030 -1.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7610 -5.9820 -5.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4030 -6.2420 -4.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0730 -9.1200 -2.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5120 -4.2310 -3.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1560 -3.1990 -3.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0220 -3.6090 -5.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3770 -4.6410 -5.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0800 -3.3300 -7.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6590 -2.2820 -7.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3970 -1.0650 -8.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5820 -1.3980 -7.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8030 0.7230 -4.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2270 -0.3300 -5.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3060 -1.2160 -5.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4770 -1.5160 -3.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8240 -2.5940 -5.5990 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 8 9 2 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 27 1 0 0 0 0 13 14 1 0 0 0 0 13 23 2 0 0 0 0 14 15 1 0 0 0 0 14 22 2 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 47 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 29 61 1 0 0 0 0 30 31 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 30 61 1 0 0 0 0 31 32 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 33 57 1 0 0 0 0 33 58 1 0 0 0 0 34 59 1 0 0 0 0 34 60 1 0 0 0 0 34 61 1 0 0 0 0 M END