IFLAB-ZINC04517378 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 0 0 0 0 0 0999 V2000 0.7270 -4.4840 7.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5600 -4.7880 5.6390 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -3.3200 4.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7040 -2.3010 5.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2230 -1.1540 5.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 -1.0070 3.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7970 -2.0060 2.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2740 -3.1770 3.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7730 -4.2520 2.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 -5.2680 3.1380 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8240 -4.1090 1.3120 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4520 -5.1730 0.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1590 -4.9160 -0.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 -5.9590 -1.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2940 -7.2700 -1.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3200 -7.5360 0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6970 -6.4780 0.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5740 -8.9300 0.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 -9.9740 -0.2310 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5630 -11.1810 0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3340 -12.4590 -0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7040 -13.5830 0.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3130 -13.4970 1.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5490 -12.2650 2.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 -11.1030 1.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3420 -9.4040 1.9730 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.6600 -8.2940 -1.9960 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 -3.5930 7.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3420 -5.3410 7.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7790 -4.3360 7.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6710 -2.4070 6.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5960 -0.3650 5.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6780 -0.1050 3.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8350 -1.8850 1.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1180 -3.2700 0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3440 -3.8970 -1.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0030 -5.7540 -2.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 -6.6760 1.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1390 -12.5460 -1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5220 -14.5520 -0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6020 -14.3960 2.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0230 -12.1990 3.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -8.5640 -2.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 35 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 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 27 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 27 43 1 0 0 0 0 M END