IFLAB-ZINC04939508 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 56 0 0 1 0 0 0 0 0999 V2000 2.1010 -1.1120 1.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6170 -0.2580 0.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7800 -1.0770 -0.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2990 -0.2120 -1.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4630 -1.0100 -3.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4040 -1.1330 -3.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5510 -1.8870 -5.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7570 -2.5320 -5.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8140 -2.4170 -4.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6680 -1.6640 -3.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9880 -3.3060 -6.5320 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1030 -3.5440 -7.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9570 -3.1030 -7.6860 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6940 -4.3950 -8.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6150 -5.1100 -9.5110 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1160 -5.8330 -8.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2410 -5.9280 -10.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4040 -6.3080 -11.5540 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1520 -4.7870 -10.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 -3.7610 -10.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 -2.1570 -11.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8760 -3.1750 -11.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6530 -1.9050 -11.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1230 -1.5420 1.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7920 -1.9310 2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9920 -0.5050 2.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9200 0.5700 0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5800 0.1830 0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4710 -1.9100 -0.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8150 -1.5240 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6140 0.6260 -1.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2610 0.2410 -1.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4540 -0.6430 -3.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6970 -1.9480 -5.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7660 -2.9080 -4.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5030 -1.5930 -2.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9100 -3.7260 -6.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3090 -3.7400 -9.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3640 -5.1420 -8.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 -5.3570 -9.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2660 -5.4660 -10.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8830 -4.2680 -10.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1330 -3.1080 -9.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -1.4850 -10.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 -1.5720 -12.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0640 -3.7950 -11.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7950 -2.6580 -10.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8320 -1.2390 -11.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5480 -2.4870 -12.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3270 -1.3440 -12.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4900 -6.0820 -10.6460 O 0 5 0 0 0 0 0 0 0 0 0 0 1.4770 -4.0860 -9.8950 N 0 3 0 0 0 0 0 0 0 0 0 0 1.3640 -3.5060 -9.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5570 -2.8700 -11.6030 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.4210 -3.4780 -12.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 52 1 0 0 0 0 17 18 2 0 0 0 0 17 51 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 19 52 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 20 54 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 21 54 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 22 52 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 23 54 1 0 0 0 0 52 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 51 -1 M CHG 1 52 1 M CHG 1 54 1 M END