IBS-ZINC04085162 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 54 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 -2.0240 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4790 -2.6650 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 -1.9270 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -0.5450 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 0.1010 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9810 -2.6290 0.0350 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.8210 -3.7070 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7770 -2.2250 -1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1930 -2.5060 -0.9540 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.9410 -1.8440 0.1400 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.1750 -0.8120 -0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1920 -2.6370 0.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1900 -2.6000 1.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2460 -3.4930 1.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2980 -4.3790 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2980 -4.4340 -0.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2290 -3.5470 -0.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0110 -3.3710 -1.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7800 -3.9260 -2.6230 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0350 -1.8870 1.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7390 -2.2460 1.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2210 -2.1690 2.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9510 -2.3960 3.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8140 -2.2300 4.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8770 -1.8570 5.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1440 -1.6260 4.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3120 -1.7850 3.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3790 -1.6170 2.6420 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.2680 -1.3720 2.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 -2.6010 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5220 -3.7440 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 0.0290 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 1.1800 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6420 -1.1610 -1.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4370 -2.8050 -2.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1560 -1.9090 2.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0470 -3.4930 1.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1420 -5.0480 -0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3430 -5.1290 -1.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1170 -2.6880 2.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8480 -2.3960 4.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7110 -1.7430 6.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9640 -1.3350 5.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 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 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 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 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 24 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 23 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 23 24 2 0 0 0 0 23 31 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 28 29 2 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 M END