IFLAB-ZINC04569426 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 0.2310 1.2490 0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 -0.1800 0.2020 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9880 -0.7930 0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0680 -2.1770 0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3020 -2.7980 0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4560 -2.0400 0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3780 -0.6600 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1480 -0.0350 0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0270 -2.8350 0.0190 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.9200 -1.9180 -0.5990 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7960 -4.1470 -0.4760 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5440 -3.0090 1.5830 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2460 -1.9830 2.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9560 -2.3530 3.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9880 -3.9030 3.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3830 -4.2140 2.4090 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.3250 -4.4530 2.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1240 -5.3880 1.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5200 -5.0140 1.5310 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.3930 -5.9280 1.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0030 -7.0370 0.7500 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.8240 -5.5830 0.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2570 -4.2800 1.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5930 -3.9610 1.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5070 -4.9290 0.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0860 -6.2280 0.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7460 -6.5570 0.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9880 -7.1750 0.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.3520 -6.7640 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2590 1.6090 0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 1.5870 -0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3250 1.6400 1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1670 -2.7690 0.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3650 -3.8760 0.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2810 -0.0710 -0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0880 1.0430 0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8520 -0.9920 2.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3180 -2.0200 2.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9740 -1.9930 4.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7340 -1.9690 4.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3760 -4.3300 4.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0120 -4.2700 3.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6500 -5.6410 0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0860 -6.2500 2.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8170 -4.1090 1.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5460 -3.5220 1.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9270 -2.9530 1.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5520 -4.6740 0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4160 -7.5660 0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.6970 -6.3910 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.4360 -5.9740 -0.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.9650 -7.6140 -0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 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 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 M END