IBS-ZINC04027270 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 61 0 0 1 0 0 0 0 0999 V2000 1.7600 -0.6550 -1.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7890 -1.6150 -0.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 -1.5640 1.1890 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9580 -1.9790 1.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9520 -0.1350 1.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 -0.1610 3.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1250 -1.0100 3.8680 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1410 -2.3160 3.2890 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 -2.4440 1.8660 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2070 -3.4890 1.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4470 -2.3290 1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5860 -2.8880 1.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8390 -2.7690 1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9650 -2.1010 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8350 -1.5700 -0.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5790 -1.7030 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5300 -1.1800 -0.7330 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4890 -0.3140 3.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1540 -1.2220 5.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3880 -1.4670 6.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 -1.8570 7.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 -3.8790 9.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7660 -5.4000 9.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0290 -5.9250 8.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1890 -5.3420 7.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1430 -3.8200 7.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0450 -3.0230 -0.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7990 -0.8470 -0.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6780 -0.7580 -2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5190 0.3930 -0.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8240 0.4270 1.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 0.4140 1.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9770 -0.5780 3.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 0.8630 3.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 -3.4080 2.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7170 -3.1950 1.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9400 -2.0020 -0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9300 -1.0640 -1.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7540 -0.0740 2.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2880 -0.9520 4.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5050 0.6260 4.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5910 -1.3960 8.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1640 -1.6000 8.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2390 -3.5290 9.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5380 -3.4480 9.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 -5.7740 10.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1150 -5.7900 8.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9030 -5.6630 9.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9930 -7.0190 8.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1400 -5.6760 6.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3930 -5.7270 6.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9760 -3.3930 7.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1660 -3.4350 6.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0550 -3.3720 -0.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3300 -3.7660 -0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9310 -3.0200 -2.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8570 -3.3610 7.8950 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0800 -3.7520 7.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 17 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 9 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 5 32 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 18 1 0 0 0 0 7 19 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 3 0 0 0 0 20 21 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 21 57 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 22 57 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 26 57 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 57 1 M END