IFLAB-ZINC04069996 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 55 0 0 0 0 0 0 0 0999 V2000 -0.5230 1.0780 -0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -0.4320 -0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5150 -0.8560 -1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7430 -2.3030 -1.2960 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2760 -3.2200 -1.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 -3.3810 -3.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1600 -4.3380 -3.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1520 -2.9020 -0.6660 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3350 -4.1880 -1.2420 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1130 -1.8600 -0.7710 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8850 -3.1610 1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4070 -4.3800 1.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -4.5900 2.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4660 -3.5690 3.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9480 -2.3420 3.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1600 -2.1470 1.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2410 -3.7860 5.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8200 -4.8560 5.6030 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5020 -2.7990 6.0860 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 -2.9640 7.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9860 -2.3810 8.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6800 -2.5410 9.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5780 -3.2800 10.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2340 -3.8700 9.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -3.7040 7.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4100 -4.6600 9.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1120 -5.1710 8.7100 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7420 -4.8330 11.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4360 1.5970 -0.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0820 1.3330 -1.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0920 1.3800 0.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2750 -0.6880 0.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2430 -0.9520 -0.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -0.6010 -2.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4730 -0.3380 -1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 -4.1910 -1.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2670 -2.8160 -1.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2020 -2.4100 -3.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8950 -3.7840 -3.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0320 -4.4530 -4.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0550 -5.3090 -3.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1510 -3.9340 -3.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 -5.1700 0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8220 -5.5420 3.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1580 -1.5480 4.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5370 -1.1990 1.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9090 -1.9730 5.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8500 -1.8010 8.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3060 -2.0850 10.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3420 -3.4020 11.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 -4.1540 7.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4020 -4.0270 11.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2410 -5.7920 11.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8240 -4.8070 11.6030 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 8 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 7 42 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 16 46 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 47 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 48 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 23 24 2 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 51 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 M END