IBS-ZINC04084074 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 56 0 0 1 0 0 0 0 0999 V2000 -0.0990 1.4910 0.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -0.0300 0.1370 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4820 -0.2870 -0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8540 -0.5750 1.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 -2.0990 1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 -2.6870 1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2780 -2.0810 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2150 -0.0190 -0.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 -0.3700 -0.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4020 0.4560 0.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7270 0.1420 0.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2960 -0.9870 0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5480 -1.8280 -0.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2130 -1.5200 -1.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7020 -2.4700 -1.8600 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6120 -3.4310 -2.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4100 -4.5190 -2.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0750 -4.7940 -3.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0380 -3.8710 -3.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7860 -4.1320 -3.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 -5.3100 -4.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5740 -6.2360 -4.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8310 -5.9840 -4.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0840 -7.2960 -5.3920 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3490 -7.2000 -5.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 -5.7930 -5.0900 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8560 -3.0880 -1.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9090 -3.7020 -1.4430 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8460 1.5800 0.8270 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8990 1.9200 0.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5880 1.8920 -0.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6850 1.7440 1.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8550 -0.1480 1.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3890 -0.3080 2.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4420 -2.3670 0.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5070 -2.4960 2.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4170 -3.7690 1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9570 -2.4530 2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7990 -2.3280 -0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2890 -2.4870 0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9530 -0.4010 -1.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0960 1.0640 -0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3050 0.7940 1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3230 -1.2280 0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2320 -5.1820 -3.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2200 -2.9540 -2.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -3.4190 -3.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6260 -6.7020 -4.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7060 -7.7690 -4.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8270 -7.5460 -6.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9500 2.3630 0.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 -0.6220 0.1900 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 4 1 0 0 0 0 2 52 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 39 1 0 0 0 0 7 40 1 0 0 0 0 7 52 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 8 42 1 0 0 0 0 8 52 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 12 13 2 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 27 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 27 28 2 0 0 0 0 29 51 1 0 0 0 0 M END