IBS-ZINC04327287 MOE2007 3D CORINA 3.40 0006 02.08.2006 64 64 0 0 0 0 0 0 0 0999 V2000 0.0190 1.5010 0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -0.0290 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7050 -0.4950 -1.1500 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8030 -1.8230 -1.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3420 -2.5720 -0.4870 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4870 -2.3810 -2.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4620 -3.9100 -2.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1470 -4.4670 -3.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5250 -3.7200 -4.5810 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3390 -5.7960 -3.8200 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1110 -6.4150 -4.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5160 -5.9240 -6.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9130 -7.0210 -6.9450 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6550 -6.7090 -7.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3050 -7.8850 -7.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4190 -7.4380 -6.4770 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5890 -8.2840 -5.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5420 -7.3700 -4.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4020 -7.6990 -3.2390 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2940 -6.5640 -2.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8070 -6.7880 -2.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1970 -6.3720 -6.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0240 -6.0020 -5.9440 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0390 -5.6400 -8.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1190 -4.5610 -8.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9610 -3.8290 -9.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0760 -4.1380 -10.2420 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8030 -2.8330 -9.7960 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5920 -2.1720 -11.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6410 -1.0740 -11.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0430 1.8740 0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5110 1.8690 -0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 1.8510 0.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 -0.3960 0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9920 -0.4010 0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9670 -2.0410 -3.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5210 -2.0350 -2.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9820 -4.2500 -1.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4290 -4.2550 -2.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1570 -6.1170 -4.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0330 -7.5010 -4.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7610 -5.1630 -6.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3060 -5.4960 -6.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2370 -5.8200 -7.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7990 -6.5220 -8.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7030 -8.1920 -8.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 -8.7200 -6.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5500 -8.7970 -5.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7830 -9.0150 -5.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4700 -6.3310 -4.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4480 -7.5050 -3.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 -5.6760 -3.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -6.4250 -1.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9980 -7.7990 -3.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2860 -6.6450 -1.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0550 -5.1740 -8.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1410 -6.3440 -8.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1030 -5.0270 -8.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0170 -3.8570 -7.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5960 -1.7300 -11.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6820 -2.9000 -11.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6370 -1.5160 -11.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5510 -0.3460 -10.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4820 -0.5780 -12.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 21 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 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 16 22 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 18 19 1 0 0 0 0 18 50 1 0 0 0 0 18 51 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 52 1 0 0 0 0 20 53 1 0 0 0 0 21 54 1 0 0 0 0 21 55 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 56 1 0 0 0 0 24 57 1 0 0 0 0 25 26 1 0 0 0 0 25 58 1 0 0 0 0 25 59 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 60 1 0 0 0 0 29 61 1 0 0 0 0 30 62 1 0 0 0 0 30 63 1 0 0 0 0 30 64 1 0 0 0 0 M END