IFLAB-ZINC04315322 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 1 0 0 0 0 0999 V2000 0.1250 1.9570 -0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 0.5850 -0.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3330 -0.0900 -0.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5380 0.6030 -0.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5170 1.9920 -0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3020 2.6610 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8370 2.3840 -0.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1590 3.2870 0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6020 1.2690 -0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8430 0.2270 -0.3570 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1080 1.2440 -0.1410 C 0 0 3 0 0 0 0 0 0 0 0 0 6.4710 0.3820 -0.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6560 2.5290 -0.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1840 2.5230 -0.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5980 2.3890 0.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5820 1.1460 1.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5410 0.9140 2.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0270 0.6660 2.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6190 0.6810 1.6200 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6980 0.4290 3.8220 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0500 0.0920 3.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9010 0.5030 4.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2360 0.1720 4.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7380 -0.5790 3.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8810 -0.9900 2.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5460 -0.6600 2.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1690 -0.9360 3.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9140 -0.5770 4.5450 O 0 0 0 0 0 0 0 0 0 0 0 0 16.6520 -1.6600 2.6230 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 2.4760 -0.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7820 0.0450 -0.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3390 -1.1580 -0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 3.7290 0.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3570 2.5800 -1.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2610 3.3920 -0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5810 1.6810 -1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5780 3.4540 -1.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6860 2.3700 0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2120 3.2380 1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2060 2.0010 1.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2050 0.2250 1.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0380 0.0450 3.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3330 1.7900 3.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2410 0.4930 4.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5120 1.0840 5.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8960 0.4920 5.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2660 -1.5710 1.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8820 -0.9810 1.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0580 -1.9460 1.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5920 -1.8940 2.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0500 1.1440 1.3480 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 9 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 13 1 0 0 0 0 11 16 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 15 51 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 16 51 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 17 51 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 M END