IFLAB-ZINC02974659 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 1 0 0 0 0 0999 V2000 2.5140 -0.4610 1.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 -0.9460 0.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7010 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1730 -1.1430 0.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1820 -1.8310 -0.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0810 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -1.6280 -0.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.7650 -2.3920 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1290 -4.0860 -2.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2740 -4.8460 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9090 -5.8000 -0.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0400 -6.6630 -2.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2760 -6.8190 -2.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 -5.8670 -4.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0910 -4.4680 -3.7680 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 -3.3240 -4.6830 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1160 -2.1350 -3.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3270 -3.4290 -5.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5060 -2.9490 -6.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7650 -3.1640 -7.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6090 -3.8190 -6.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8050 -4.2090 -4.9300 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0800 -3.2190 -5.5480 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9250 -1.2310 1.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2220 -0.2470 0.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3320 0.4460 1.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.1630 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1010 -0.9480 1.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1150 -2.1760 -0.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1520 -1.8150 -1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -5.4270 -1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3370 -4.1330 -0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6980 -6.4410 -0.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8230 -5.2310 -0.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -7.6510 -1.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7610 -6.1860 -2.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1070 -6.5350 -2.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 -7.8450 -3.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0590 -5.9970 -4.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 -6.1200 -4.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0720 -1.6190 -3.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7100 -1.4480 -3.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7280 -2.4310 -7.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0440 -2.8270 -8.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6290 -4.0750 -6.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0330 -2.4800 -6.1700 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 17 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 23 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 23 46 1 0 0 0 0 M CHG 1 8 1 M END