IFLAB-ZINC00710360 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 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 -1.7240 -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 -2.9350 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 -6.1550 -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 -6.7880 -3.2750 -5.0790 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.0830 -4.2330 -5.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8870 -5.4020 -5.7110 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6450 -3.8620 -7.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9520 -4.8520 -8.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4760 -4.4990 -9.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6980 -3.1680 -9.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3960 -2.1810 -8.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8760 -2.5210 -7.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7360 -0.1690 -9.3120 I 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 -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 -6.2930 1.8640 0.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8480 -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 -5.0210 -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 -7.0140 -2.3500 -5.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7790 -5.8910 -7.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7140 -5.2640 -10.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1090 -2.8970 -10.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6440 -1.7510 -6.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 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 34 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 35 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 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 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 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 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 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 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 28 2 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 29 47 1 0 0 0 0 M END