IFLAB-ZINC04248494 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 0 0 0 0 0 0999 V2000 0.3360 1.6060 1.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3340 0.1100 1.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5430 -0.6050 1.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5440 -1.9450 1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3740 -2.6250 0.9520 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 -3.9520 0.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2480 -4.0620 0.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7870 -2.8440 0.7420 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 -1.9550 0.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8400 -0.5560 1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0080 -5.3450 0.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0760 -5.4950 1.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8150 -6.7420 1.3020 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7670 -7.3540 2.5100 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.3660 -8.5330 1.9900 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9770 -7.3400 3.6910 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0770 -6.2060 2.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2560 -6.3280 2.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2850 -5.4300 2.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1340 -4.4020 3.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9490 -4.2820 3.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9260 -5.1870 3.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1740 -3.4900 3.3980 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.4560 -3.8930 3.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7100 -5.0660 3.1140 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.5740 -2.8880 3.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3610 1.9550 1.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1000 2.0770 0.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2500 1.8700 2.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4760 -0.0800 1.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4790 -2.4850 1.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8090 -4.7600 0.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7760 -0.0170 1.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4860 -5.3230 -0.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3190 -6.1880 0.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5980 -5.5170 2.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7650 -4.6520 1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7460 -7.2090 0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3730 -7.1270 1.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2050 -5.5250 1.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8290 -3.4840 4.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0060 -5.0960 4.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9730 -2.5670 3.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8070 -2.4970 2.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4570 -3.3700 3.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2650 -2.0700 4.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 10 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 M END