IFLAB-ZINC04315363 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 1 0 0 0 0 0999 V2000 0.0550 0.7200 -0.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 0.9210 0.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 1.1770 1.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4590 1.2260 0.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4120 1.0220 -0.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 0.7670 -1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7160 1.1350 -0.9000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0480 1.0430 -1.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4860 1.3940 0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7480 1.4530 1.2960 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9680 1.5670 0.1470 C 0 0 3 0 0 0 0 0 0 0 0 0 6.3760 0.8530 -0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3350 2.9870 -0.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8450 3.2080 -0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4260 2.8970 1.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5770 1.2520 1.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7430 1.0440 2.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1350 0.5070 2.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4290 0.2420 1.3320 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9180 0.3650 3.6270 N 0 0 0 0 0 0 0 0 0 0 0 0 12.2390 -0.1300 3.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8460 -0.1960 4.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1480 -0.6810 5.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8690 -1.1010 3.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2600 -1.0400 2.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9560 -0.5560 2.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2600 -1.6520 4.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2630 -3.0030 4.2580 F 0 0 0 0 0 0 0 0 0 0 0 0 17.0470 -1.3990 3.0150 F 0 0 0 0 0 0 0 0 0 0 0 0 16.9260 -1.1420 5.1690 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.8920 0.5240 -0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8580 0.8790 1.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2880 1.3340 2.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 0.6110 -2.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9650 3.1740 -1.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8460 3.7270 0.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3250 2.5750 -1.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0700 4.2470 -0.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5180 2.9720 1.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0250 3.5630 1.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1720 1.8850 2.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4140 0.2000 1.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1520 0.2310 3.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7650 1.8990 3.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5280 0.6340 4.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3180 0.1230 5.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5980 -0.7300 6.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7980 -1.3720 1.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5340 -0.5300 1.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0680 1.4810 1.4950 N 0 3 0 0 0 0 0 0 0 0 0 0 8.4860 0.8620 0.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 15 50 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 16 50 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 17 50 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 30 1 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 50 1 M END