IBS-ZINC04295259 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 57 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3790 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -0.6800 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 0.0310 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4200 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0890 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 -0.6490 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7480 0.2930 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0600 -0.4880 -0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1590 -1.4170 0.9960 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0310 -2.3590 1.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7190 -1.5780 1.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3630 -2.0880 0.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2280 -1.8310 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3930 -2.4500 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6970 -3.3870 0.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7580 -3.6350 1.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6190 -2.9660 1.9440 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0190 -4.6360 3.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5160 -4.8750 3.2360 C 0 0 3 0 0 0 0 0 0 0 0 0 10.9890 -3.9620 3.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1380 -5.2750 1.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9840 -4.0970 0.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8890 -3.7520 0.2200 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7300 -5.9820 4.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4400 -5.7360 5.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6360 -6.7500 6.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1240 -8.0110 6.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4140 -8.2570 4.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2120 -7.2400 3.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7700 -9.8400 4.6080 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -1.7600 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3030 1.9760 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1510 3.1690 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6590 0.9610 -0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7390 0.8760 0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0810 -1.0510 -1.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9000 0.2060 -0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0400 -2.9430 0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1200 -3.0280 1.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6980 -1.0150 2.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8790 -2.2730 1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0970 -2.2400 -0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6010 -4.2630 3.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5350 -5.5780 2.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1950 -5.5060 2.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6170 -6.1430 1.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8400 -4.7510 5.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1910 -6.5570 7.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2770 -8.8030 6.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6550 -7.4310 3.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 16 17 2 0 0 0 0 16 23 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 25 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 24 2 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 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 29 2 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 30 53 1 0 0 0 0 M END