IFLAB-ZINC04139256 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 48 0 0 1 0 0 0 0 0999 V2000 0.8760 0.9430 -0.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.5630 -0.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4440 -1.2450 0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8780 -0.8190 -0.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1670 -2.2910 -0.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 -3.0600 -0.8640 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 -2.7540 -0.3870 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6990 -4.1850 -0.5240 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8430 -4.7590 -0.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9600 -4.5150 -1.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9340 -4.5440 0.3060 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.8090 -4.0450 -0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7290 -4.0970 1.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3250 -3.0470 2.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9820 -2.8290 3.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1080 -3.7010 4.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6750 -4.8820 2.8980 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.8540 -6.7120 0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1150 -8.2210 0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9080 -8.5820 -0.8030 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1670 -7.9060 -0.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9270 -6.3940 -0.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9330 1.1260 -0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2780 1.4300 -1.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 1.3480 0.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8750 -0.9670 -1.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 -0.8410 1.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2520 -2.3180 0.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5020 -1.0620 0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1270 -0.4950 0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4780 -0.2600 -1.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1330 -2.1390 -0.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9500 -4.1580 -2.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2070 -4.0290 -2.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9080 -5.5940 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0210 -2.4160 1.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3910 -2.0140 4.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7270 -3.6860 5.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2980 -6.4240 1.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2740 -6.4590 -0.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1650 -8.7550 0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6470 -8.4820 1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7010 -8.2120 -1.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7590 -8.1580 0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3810 -6.1350 -1.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8840 -5.8730 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1390 -5.9990 0.2740 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 47 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 M END