IFLAB-ZINC02723184 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 0 0 0 0 0 0999 V2000 -0.0050 1.4490 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 0.0200 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 -0.5820 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 -1.9660 -1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3060 -2.5780 -2.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8600 -1.8090 -3.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7970 -0.4240 -3.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 0.1880 -2.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4850 -2.4300 -4.3020 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4440 -3.4190 -4.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7660 -3.7260 -5.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0330 -2.9560 -6.3360 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2550 -2.1760 -5.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1100 -0.9980 -6.2610 S 0 0 0 0 0 0 0 0 0 0 0 0 1.3700 -1.2380 -8.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 -0.3070 -8.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2750 0.4440 -8.2130 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4910 -0.3100 -10.1530 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4090 0.4830 -10.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7930 1.7120 -10.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6900 2.5100 -11.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2110 2.1020 -12.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8450 0.8550 -12.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 0.0350 -12.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 -1.2070 -12.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0810 -1.6070 -13.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9780 -0.7990 -14.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3670 0.4070 -14.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0150 1.8330 -0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5370 1.8040 -0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 1.8000 0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2600 -2.5650 -0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3550 -3.6560 -2.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2290 0.1760 -3.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 1.2650 -2.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8580 -3.8620 -3.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4910 -4.4660 -5.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4100 -1.0250 -8.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 -2.2700 -8.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1320 -0.8630 -10.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3940 2.0600 -9.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9770 3.4700 -10.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9060 2.7350 -12.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 -1.8430 -12.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7950 -2.5630 -14.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3760 -1.1390 -15.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0630 1.0220 -14.5820 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 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 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 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 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 28 47 1 0 0 0 0 M END