IBS-ZINC05353852 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 61 0 0 1 0 0 0 0 0999 V2000 3.2780 -1.8200 2.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7250 -0.3830 1.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2810 -0.0180 2.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7030 -0.4360 0.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5200 0.5610 1.6430 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8660 0.1400 0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0470 1.9510 1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3110 2.7550 2.1200 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7130 0.7630 2.8620 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -0.0240 3.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 -0.9760 2.6140 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 0.4090 4.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0790 0.6650 5.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8740 -0.5890 6.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9890 -1.6720 6.4550 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0990 -1.9960 5.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8980 -0.7510 5.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2330 -2.3610 7.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1540 -2.1000 8.4020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3310 -3.3590 7.8450 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 -4.2060 9.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 -3.3900 10.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7940 -5.1760 8.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6860 -5.0170 9.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8950 1.6380 4.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9060 1.5520 3.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7300 2.6420 3.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5640 3.8450 3.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5730 3.9550 4.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7450 2.8660 4.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6620 -2.2220 1.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1430 -2.4800 2.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7040 -1.8790 3.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1890 -0.7110 -0.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2030 0.5250 0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4930 -1.1750 0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9910 1.6030 3.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7790 1.4580 5.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5870 1.0080 6.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4630 -0.9380 5.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5850 -0.3540 6.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3550 -2.4740 4.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7850 -2.7290 5.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4570 -0.4010 6.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6490 -1.0500 4.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 -2.7520 10.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -4.0420 11.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 -2.7270 10.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 -5.7520 7.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 -5.8780 9.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7410 -4.6280 8.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5590 -4.3830 9.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6600 -5.7740 9.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8600 -5.5210 8.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0550 0.6300 2.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4960 2.5480 2.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2000 4.6950 3.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 4.8940 5.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 3.0140 5.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1150 2.1160 -0.0760 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 60 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 55 1 0 0 0 0 27 28 1 0 0 0 0 27 56 1 0 0 0 0 28 29 2 0 0 0 0 28 57 1 0 0 0 0 29 30 1 0 0 0 0 29 58 1 0 0 0 0 30 59 1 0 0 0 0 M CHG 1 60 -1 M END