IBS-ZINC04980907 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 62 0 0 1 0 0 0 0 0999 V2000 1.7610 3.3200 -0.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9290 3.2160 2.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3080 4.8110 1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7140 4.8260 2.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5460 6.1050 2.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5430 6.1450 3.3430 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2220 6.4620 4.7350 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5620 5.6600 5.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5480 6.3480 5.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5640 5.9880 4.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8750 5.8700 3.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4390 5.5710 2.0890 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7600 5.7910 4.5920 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8240 6.4900 6.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0970 6.3370 7.2690 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8050 6.8130 7.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5570 8.1450 8.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5940 8.4510 9.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8910 7.4300 9.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1480 6.0950 9.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0980 5.7930 8.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 5.0070 9.9690 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2810 5.2490 11.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5370 7.8080 4.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1620 8.9950 4.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4890 10.2130 4.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 10.2650 5.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4550 9.0970 5.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2240 7.8780 5.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7280 9.0050 5.9300 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4420 10.2240 6.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2000 2.3190 -0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5350 4.0900 -0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0420 3.4260 -0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6640 4.0240 2.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4210 2.2530 2.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 3.1650 3.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1980 4.9480 0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0680 5.5910 1.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3750 3.9540 2.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2090 4.7640 3.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9080 6.9910 2.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0660 6.1580 1.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0810 6.4840 8.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1000 8.9540 7.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3940 9.4900 9.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1530 7.7110 10.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2950 4.7500 8.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1730 5.8190 10.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2770 5.7520 11.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 4.2800 11.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1750 8.9840 4.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9810 11.1270 4.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3050 11.2330 5.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 6.9750 5.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4200 9.9830 6.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6120 10.7150 5.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9280 10.8920 6.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0210 3.4770 1.1340 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2990 2.7430 1.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 59 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 2 59 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 3 59 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 24 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 1 0 0 0 0 10 13 2 0 0 0 0 11 12 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 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 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 28 2 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 29 55 1 0 0 0 0 30 31 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 59 60 1 0 0 0 0 M CHG 1 59 1 M END