IBS-ZINC04870385 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 -0.6850 0.9770 -1.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2080 0.8760 0.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9480 2.9480 -0.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1950 3.5260 -1.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3780 4.9300 -0.7320 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6890 6.0120 -1.4230 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6170 5.7910 -1.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0060 7.2330 -0.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0410 6.8400 0.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1860 5.3530 0.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8680 4.6830 1.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7060 7.5340 1.1390 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4300 8.4380 -0.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7650 9.4390 0.2590 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3690 8.7650 -1.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6940 9.3310 -2.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3080 9.5860 -3.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6340 9.2850 -3.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9700 8.7430 -2.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9680 8.4830 -1.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8650 9.5750 -4.6110 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.1140 6.1200 -2.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4450 6.3610 -3.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7960 6.4620 -4.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8270 6.3250 -5.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4990 6.0830 -5.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1520 5.9760 -3.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4530 5.9290 -6.1070 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7310 6.1250 -7.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6030 -0.1130 -1.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2220 1.4340 -2.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5660 1.2680 -2.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 1.2730 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 -0.2130 0.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 1.1700 1.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 3.3740 -0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9750 3.1610 0.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1410 3.4350 -2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0800 2.9740 -0.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2310 10.2280 0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7290 9.5560 -3.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 10.0070 -4.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0060 8.5210 -1.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2380 8.0560 -0.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2250 6.4730 -2.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8310 6.6530 -4.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1420 6.4130 -6.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1090 5.7960 -3.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 7.1360 -7.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2080 6.0110 -8.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4290 5.3680 -7.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8650 1.4440 -0.5410 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.7530 1.0470 -0.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 52 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 2 52 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 3 52 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 22 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 1 0 0 0 0 9 12 2 0 0 0 0 10 11 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 40 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 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 44 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 52 1 M END