IFLAB-ZINC02468219 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1380 -0.7850 -1.0280 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3040 -1.2170 -0.8090 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6710 -1.3630 0.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3720 -0.9000 1.4440 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.9110 -1.8230 0.8570 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8530 -2.1630 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6190 -2.0670 -1.2310 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1970 -2.6620 0.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2330 -3.0320 -1.0180 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.6980 -3.5790 -0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8740 -3.6540 1.0930 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.1120 -4.1120 1.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7330 -4.3320 0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8440 -3.9910 -0.8190 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.0740 -4.0570 -2.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5850 -5.2180 -2.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8110 -5.2810 -4.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5270 -4.1880 -4.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0160 -3.0300 -4.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7950 -2.9610 -3.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7470 -4.2530 -6.2600 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0990 -1.9000 1.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0630 -3.5660 1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6790 -1.8960 1.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5350 -4.2760 2.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7390 -4.7020 0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8070 -6.0700 -2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2080 -6.1840 -4.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7950 -2.1790 -4.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4010 -2.0560 -2.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 2 0 0 0 0 3 7 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 30 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 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 M END