IBS-ZINC05347618 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -0.0070 1.3180 -0.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -0.0970 -0.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2090 -0.7100 0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3680 0.0400 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6070 -0.5790 0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6760 -1.9720 0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0450 -2.3140 0.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7680 -1.1700 0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9000 -0.1050 0.0420 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1590 0.8210 -0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2320 -1.0810 0.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9020 -2.0850 0.3840 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8360 0.1140 0.0740 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.2300 0.1860 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9060 1.2860 0.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2820 1.3550 0.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9880 0.3310 -0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3180 -0.7660 -0.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9400 -0.8380 -0.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2080 -2.0500 -1.4740 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.4900 -2.7250 0.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2690 -2.0910 0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1180 -2.8160 0.3080 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4600 -2.9900 1.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5460 -4.0690 0.5490 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6000 -4.8880 -0.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 1.6800 -0.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 1.5530 -1.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5030 1.8010 0.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3100 1.1080 -0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4460 -3.3050 0.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3050 0.9240 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3550 2.0860 0.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8070 2.2100 0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0640 0.3870 -0.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4170 -1.6930 -1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7020 -2.0150 2.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2490 -3.5020 2.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3700 -3.5840 1.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6420 -5.9380 -0.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4890 -4.6370 -1.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7110 -4.7150 -1.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 22 2 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 21 2 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 36 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 25 26 1 0 0 0 0 26 40 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 M END