IFLAB-ZINC02709578 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 0 0 0 0 0 0999 V2000 -0.8200 1.8850 0.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6170 0.4740 0.4420 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7250 -0.3040 0.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6100 -1.6850 0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7750 -2.4430 0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9530 -1.8230 0.2190 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0220 -0.5050 0.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9360 0.2450 0.3910 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2380 0.0910 0.3360 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2600 1.5160 0.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7100 -3.8240 0.0940 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1040 -4.7140 0.0060 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7050 -6.0720 -0.1210 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9460 -4.2460 1.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9010 -4.2860 -1.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6190 -4.9940 -2.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2420 -4.6610 -3.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1540 -3.6140 -3.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4360 -2.9050 -2.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8130 -3.2460 -1.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7870 -3.2740 -5.0800 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.0820 -4.2320 -5.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8860 -5.4010 -5.7110 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6430 -3.8610 -7.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8690 -2.5190 -7.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3930 -2.1800 -8.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6950 -3.1650 -9.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4740 -4.4970 -9.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9450 -4.8500 -8.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8060 -5.5640 -10.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3190 -4.9670 -11.6270 F 0 0 0 0 0 0 0 0 0 0 0 0 -7.6470 -6.2800 -10.7900 F 0 0 0 0 0 0 0 0 0 0 0 0 -9.7590 -6.4350 -9.9330 F 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 2.3880 0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3650 2.2360 -0.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3960 2.1070 1.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6400 -2.1590 0.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2930 1.8640 0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7670 1.8210 1.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7370 1.9500 -0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8490 -4.2680 0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9090 -5.8080 -2.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0200 -5.2140 -4.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1450 -2.0910 -2.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0350 -2.6980 -0.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0130 -2.3490 -5.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6340 -1.7490 -6.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5690 -1.1420 -9.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1060 -2.8940 -10.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7680 -5.8890 -8.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 12 13 2 0 0 0 0 12 14 2 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 28 2 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 29 50 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 33 1 0 0 0 0 M END