IFLAB-ZINC04062689 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 2.5550 -0.8970 0.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 -1.0480 0.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -0.8070 1.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1680 -1.0830 0.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5400 -1.0280 0.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4120 -1.3590 -0.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9260 -1.7450 -1.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5700 -1.8040 -1.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 -1.4740 -0.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7050 -1.4340 -0.8990 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5980 -1.7680 -2.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -0.3660 2.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 0.8180 2.7830 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -1.3700 3.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -2.5560 3.3630 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 -0.9600 4.9010 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2380 -1.9450 5.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3360 -1.2210 7.3260 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5030 -0.5330 7.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3160 -2.2450 8.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4220 -1.5370 9.7080 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3740 -0.5670 9.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7780 -0.0970 11.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7420 0.8890 11.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3060 1.4110 9.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9100 0.9470 8.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.0440 8.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5680 -0.4950 7.3950 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9140 -1.8400 1.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1620 -0.6240 -0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6300 -0.1170 1.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9200 -0.7280 1.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4780 -1.3170 -0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6180 -2.0020 -2.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2030 -2.1060 -2.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8320 -2.8320 -1.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1070 -1.5300 -2.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5180 -1.1910 -1.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1620 -0.0120 5.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1240 -2.5650 5.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6510 -2.5750 5.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1580 -2.9300 8.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6190 -2.8050 8.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3380 -0.5030 11.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0550 1.2530 12.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0590 2.1830 10.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3520 1.3570 7.8220 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 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 12 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 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 28 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 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 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 M END