IBS-ZINC01178360 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 65 0 0 0 0 0 0 0 0999 V2000 0.5630 0.6550 -0.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4160 -0.8440 -0.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 -1.6530 -0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 -3.0250 -0.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 -3.5960 -1.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6680 -2.7750 -1.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 -1.4040 -1.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5670 -0.3650 -2.6960 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.3720 -1.2290 -3.4860 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1060 0.6100 -1.8140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 0.4520 -3.7500 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 -0.2170 -4.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2150 1.8430 -3.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -5.0690 -1.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -5.8770 0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2920 -5.2960 1.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3580 -6.0970 2.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2190 -7.4750 2.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -8.0700 1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -7.2780 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2760 -7.8580 -1.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4030 -9.0610 -1.4340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 -7.0360 -2.3640 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1980 -5.6540 -2.2380 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 -7.6120 -3.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0310 -7.6810 -3.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8250 -7.2880 -3.1460 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4720 -8.1790 -5.1470 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8380 -8.1370 -5.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6230 -7.0890 -4.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9690 -7.0480 -5.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5360 -8.0540 -6.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7530 -9.1010 -6.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4060 -9.1410 -6.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8620 -8.0130 -6.3710 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3800 -9.0810 -7.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3390 0.9770 -1.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3830 1.1250 -1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8380 0.9450 0.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9640 -1.2100 0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7340 -3.6560 0.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 -3.2120 -2.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 0.0050 -5.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9200 0.1400 -5.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0590 -1.2940 -4.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7450 1.8710 -2.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1400 2.3890 -4.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9770 2.3060 -2.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4010 -4.2260 1.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5190 -5.6480 3.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2740 -8.0860 3.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0940 -9.1420 1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 -6.9860 -4.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 -8.6150 -3.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8440 -8.5670 -5.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1810 -6.3060 -4.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5790 -6.2330 -4.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1960 -9.8840 -7.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7950 -9.9540 -6.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4460 -8.9270 -7.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8620 -9.1040 -8.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2260 -10.0280 -6.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 5 6 2 0 0 0 0 5 14 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 46 1 0 0 0 0 13 47 1 0 0 0 0 13 48 1 0 0 0 0 14 15 1 0 0 0 0 14 24 2 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 49 1 0 0 0 0 17 18 1 0 0 0 0 17 50 1 0 0 0 0 18 19 2 0 0 0 0 18 51 1 0 0 0 0 19 20 1 0 0 0 0 19 52 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 56 1 0 0 0 0 31 32 1 0 0 0 0 31 57 1 0 0 0 0 32 33 2 0 0 0 0 32 35 1 0 0 0 0 33 34 1 0 0 0 0 33 58 1 0 0 0 0 34 59 1 0 0 0 0 35 36 1 0 0 0 0 36 60 1 0 0 0 0 36 61 1 0 0 0 0 36 62 1 0 0 0 0 M END