COMGENEX-ZINC04589652 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 -0.0220 1.8100 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9870 -0.4940 0.9020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3220 -0.5210 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 -0.4010 -1.4960 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0260 -0.5630 -1.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 -2.0420 -1.5690 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8490 -2.6290 -2.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9130 -2.2220 -1.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4020 -2.8760 -0.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0930 -3.4830 0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0860 -2.5060 -0.2450 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3420 -0.5900 -2.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4560 0.6940 -3.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 1.6710 -3.0520 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2580 0.7560 -4.4770 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3680 2.0050 -5.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3240 2.0260 -6.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6170 1.5110 -7.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3410 1.5310 -8.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5900 2.0660 -8.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8820 2.5810 -7.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9230 2.5660 -6.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0200 -0.4240 -4.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3620 -0.4220 -4.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4700 0.1450 -4.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5880 0.0180 -3.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3890 -0.6520 -2.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7110 -1.1730 -2.6580 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 2.1870 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 2.1710 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 2.1610 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 -0.2110 -2.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5670 0.0160 -0.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1060 -2.8790 -2.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3960 -1.2560 -1.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1360 -3.6550 -0.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8080 -2.1270 0.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8760 -4.4400 -0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1590 -3.5970 1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -1.3800 -3.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3230 -0.8700 -2.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3600 2.0710 -5.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2140 2.8510 -4.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5930 1.0930 -7.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1130 1.1280 -9.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3390 2.0800 -9.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8580 2.9990 -6.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 2.9720 -5.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1620 -0.4020 -5.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4730 -1.3250 -4.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4920 0.6630 -5.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5490 0.4300 -4.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1430 -0.8470 -2.0010 H 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 2 0 0 0 0 2 4 2 0 0 0 0 2 5 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 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 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 26 2 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 28 2 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 M END