IBS-ZINC05347343 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 -0.0150 1.5480 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 0.0190 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3650 -0.4770 -0.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5290 -1.8090 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 -2.5360 0.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9160 -2.3980 0.0590 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4500 -2.0410 0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8220 -3.9250 0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2300 -4.5220 0.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9990 -4.1210 -1.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9690 -2.6580 -1.2340 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6700 -1.9720 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1120 -1.9580 -1.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0840 -0.7410 -1.3750 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3930 -2.6630 -1.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7880 -3.3500 -2.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0760 -3.8780 -2.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9640 -4.6560 -3.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1780 -5.0230 -2.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5260 -4.6230 -1.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6630 -3.8590 -0.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4320 -3.4780 -1.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3840 -2.7390 -0.5670 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.3490 -2.3360 0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0430 -5.7780 -3.3170 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.2840 -6.1220 -2.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9960 -3.5190 -3.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0090 1.9210 -0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 1.8800 -0.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5310 1.9340 0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5150 -0.3660 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 -0.3120 0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3090 -4.2830 -0.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2650 -4.2290 0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1620 -5.6090 0.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7520 -4.1450 1.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5280 -4.5740 -1.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0320 -4.4610 -1.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8260 -0.8930 -1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0910 -2.2480 -2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6990 -4.9670 -4.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4800 -4.9150 -0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9420 -3.5550 0.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8300 -5.2130 -2.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8780 -6.7240 -3.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0910 -6.6930 -1.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3790 -4.4150 -3.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6800 -3.6160 -4.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3580 -2.6490 -4.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 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 8 1 0 0 0 0 6 12 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 16 27 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 41 1 0 0 0 0 19 20 1 0 0 0 0 19 25 1 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 25 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 27 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 M END