IBS-ZINC03850476 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 1 0 0 0 0 0999 V2000 0.1210 1.4640 0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1090 -0.0430 0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1380 -0.6940 1.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 -2.0740 1.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -2.8080 0.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 -2.1520 -0.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3380 -0.7710 -0.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -2.9440 -2.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 -4.2090 0.3620 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0850 -4.8650 0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1140 -4.2580 -0.0850 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0710 -6.3380 0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2200 -7.0780 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1460 -8.4200 -0.1240 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3720 -9.2140 -0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0120 -10.6970 -0.3400 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4420 -11.0070 0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2950 -11.5410 -0.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1340 -12.2930 -1.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6020 -12.2320 -2.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2380 -10.9220 -1.5300 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2200 -6.9870 0.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3110 -8.1990 0.5420 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 -6.2020 0.6800 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2150 -4.8660 0.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2250 -4.2150 0.7940 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1310 1.8250 0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2000 1.7990 -0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5580 1.8560 0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3210 -0.1220 2.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 -2.5820 2.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5270 -0.2600 -1.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3560 -3.1340 -2.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 -2.3800 -2.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0590 -3.8930 -1.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1760 -6.5820 -0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2810 -8.8590 -0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9840 -9.0560 0.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9310 -8.9080 -1.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3630 -12.2480 0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1740 -10.8980 -0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4730 -13.3250 -1.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6660 -11.7780 -2.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0980 -13.0100 -1.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3660 -12.3210 -3.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1570 -6.6130 0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 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 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 32 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 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 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 21 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 M END