IFLAB-ZINC04940743 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 1 0 0 0 0 0999 V2000 0.3630 1.7960 -1.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4420 0.3160 -2.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 -0.4640 -1.1640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 -1.8100 -1.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0390 -2.6270 -0.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 -3.9940 -0.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 -4.5510 -1.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 -3.7330 -2.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6470 -2.3670 -2.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1020 -5.9380 -1.8350 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 -6.7700 -0.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 -6.3220 0.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8970 -8.2550 -0.9930 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9650 -8.4590 -1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -8.7660 -2.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3520 -8.9340 0.1850 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9210 -8.9210 0.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7750 -8.3020 0.0050 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2510 -9.6780 1.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4810 -9.8380 2.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5640 -10.6030 3.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4440 -11.2280 4.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2220 -11.0820 3.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1350 -10.3230 2.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 -9.8910 1.2730 S 0 0 0 0 0 0 0 0 0 0 0 0 1.5790 -11.0730 0.5880 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0770 -9.0470 1.9890 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4450 1.9440 -1.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3070 2.1070 -1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1700 2.3900 -2.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 0.0050 -2.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 0.1680 -3.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 -2.1930 0.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 -4.6290 0.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6420 -4.1660 -3.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4520 -1.7310 -3.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4780 -6.3000 -2.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3490 -9.8400 -2.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8770 -8.5620 -2.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5970 -8.2600 -3.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3660 -9.3570 2.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5160 -10.7160 4.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5220 -11.8260 5.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 -11.5660 3.9020 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 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 25 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 2 0 0 0 0 M END