IFLAB-ZINC04056949 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 48 0 0 1 0 0 0 0 0999 V2000 1.1280 -0.4780 -0.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.0020 -0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 1.2240 0.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 -0.7180 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3250 -1.8800 -0.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5110 -2.5880 -0.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5790 -2.1370 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4560 -0.9750 0.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2680 -0.2700 0.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7830 -2.8540 0.0310 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7680 -4.1980 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7120 -4.7930 -0.0920 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0640 -4.9600 -0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7680 -6.4560 -0.2960 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.1470 -6.7680 0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0620 -7.2270 -0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3630 -7.9260 -1.2170 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2540 -7.9470 -1.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5310 -8.1890 -2.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6930 -9.4660 -2.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0180 -9.6920 -3.9210 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2030 -10.8660 -3.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9700 0.2050 -0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4190 -1.4730 -0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8340 -0.5180 -1.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 2.0800 0.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 1.1560 1.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 1.3490 1.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 -2.2310 -1.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6070 -3.4910 -1.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2870 -0.6240 1.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1710 0.6320 1.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6270 -2.3840 0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6670 -4.7740 0.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6090 -4.6290 -1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9050 -8.7930 -1.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5200 -7.8380 -0.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2640 -8.2990 -3.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8790 -7.3430 -3.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -9.3560 -1.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3450 -10.3120 -2.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8240 -11.7410 -3.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 -10.9670 -4.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 -10.7860 -3.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8820 -7.1380 0.7810 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0580 -6.7210 -1.5550 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7020 -6.7720 -2.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7010 -7.6510 0.7470 H 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 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 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 30 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 46 1 0 0 0 0 16 17 2 0 0 0 0 16 45 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 45 48 1 0 0 0 0 46 47 1 0 0 0 0 M END