IFLAB-ZINC04194870 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 54 0 0 0 0 0 0 0 0999 V2000 0.2400 1.8200 0.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2200 0.2900 0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9380 -0.2080 -1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9170 -1.7380 -1.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6360 -2.2360 -2.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6160 -3.7010 -2.4350 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5510 -4.3520 -2.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 -5.5630 -3.0470 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 -3.6610 -3.3350 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6410 -4.3170 -3.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6550 -5.5320 -3.7610 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7300 -3.6250 -4.1370 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8420 -4.3030 -4.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1920 -5.5480 -4.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2900 -6.2140 -4.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0400 -5.6430 -5.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6950 -4.4030 -6.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6010 -3.7290 -5.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2380 -6.3730 -6.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9030 -4.5560 -1.8400 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9440 -5.7770 -2.5660 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9950 -3.6490 -1.7820 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5200 -4.9810 -0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8670 -6.1670 0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5670 -6.5000 1.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9210 -5.6470 2.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5760 -4.4620 2.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8790 -4.1310 0.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 2.1690 0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2660 2.2050 -0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2710 2.1750 1.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7260 -0.0950 1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8130 -0.0590 0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 0.1770 -2.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9700 0.1410 -1.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4240 -2.1230 -0.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1150 -2.0870 -1.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 -1.8510 -3.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6680 -1.8870 -2.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 -2.6910 -3.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7420 -2.6580 -4.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6060 -5.9950 -3.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5630 -7.1820 -4.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2830 -3.9590 -6.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3340 -2.7590 -6.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1260 -6.0960 -5.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3770 -6.1020 -7.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0760 -7.4480 -6.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5900 -6.8320 -0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0550 -7.4260 1.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6860 -5.9070 3.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8520 -3.7960 2.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3940 -3.2070 0.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 20 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 40 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 41 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 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 45 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 M END