IBS-ZINC04084120 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 61 0 0 1 0 0 0 0 0999 V2000 -4.7050 -7.0740 -0.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4290 -6.4850 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4900 -5.0580 -0.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4270 -4.3750 0.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3480 -5.0630 1.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2690 -4.3660 1.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2630 -2.9830 1.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3370 -2.2950 0.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4160 -2.9880 0.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5840 -2.2370 -0.1250 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5310 -1.1910 0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5350 -2.3320 -1.6510 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5800 -3.3790 -1.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2360 -1.7120 -2.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1740 -0.2380 -1.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3690 0.5040 -2.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6670 -0.1120 -1.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7310 -1.5820 -2.2430 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.0230 -2.1900 -1.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0040 -2.1000 -0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8620 -2.8740 1.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9420 -3.8220 2.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6050 -4.6080 1.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5960 -5.4770 1.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9240 -5.5610 3.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2620 -4.7760 4.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2660 -3.9100 3.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4280 -2.9300 4.7880 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -4.7100 -1.6920 -3.6670 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6590 -8.1630 -0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5700 -6.7240 0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7950 -6.7570 -1.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3390 -6.8020 1.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5640 -6.8360 -0.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3520 -6.1420 1.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 -4.9010 1.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5810 -2.4400 1.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3310 -1.2150 0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3860 -2.2430 -1.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2020 -1.7920 -3.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2070 -0.1580 -0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2480 0.2020 -2.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3250 1.5550 -2.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3380 0.4200 -3.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6960 -0.0300 -0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5190 0.4190 -2.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8810 -1.6390 -2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0940 -3.2350 -1.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9450 -1.0540 0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9160 -2.5430 0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0640 -1.8770 2.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8960 -3.2200 2.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3500 -4.5420 0.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1140 -6.0900 1.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6990 -6.2400 3.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5180 -4.8420 5.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4410 -1.2380 -4.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8380 -2.8250 0.3620 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 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 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 58 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 18 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 29 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 20 58 1 0 0 0 0 21 22 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 21 58 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 53 1 0 0 0 0 24 25 1 0 0 0 0 24 54 1 0 0 0 0 25 26 2 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 26 56 1 0 0 0 0 27 28 1 0 0 0 0 29 57 1 0 0 0 0 M END