IBS-ZINC05025478 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 0 0 0 0 0 0999 V2000 1.4280 0.3650 1.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 -0.9190 1.2140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4940 -1.1070 -0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0460 -0.1570 -0.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3350 -0.4730 -2.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0730 -1.7630 -2.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5130 -2.6880 -1.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -2.3910 -0.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3270 -3.8610 -2.6020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9380 -4.7070 -2.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -3.7350 -3.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2230 -2.4400 -4.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7180 -2.0600 -5.3140 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2800 -0.8580 -5.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5070 0.1230 -4.9820 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6660 -0.8210 -7.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6090 0.7320 -8.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7220 1.5960 -9.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9080 2.4130 -8.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5770 1.4030 -7.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6750 -4.7880 -4.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0420 -4.6610 -6.0490 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 -5.9130 -4.3270 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 -7.0250 -5.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4970 0.5990 1.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8400 1.1380 1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1180 0.3430 2.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 0.8500 -0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7590 0.3070 -2.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -3.1390 0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6430 -2.8020 -6.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6290 -1.3310 -7.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9120 -1.2980 -7.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7870 -0.2590 -9.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5610 1.2200 -8.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3020 2.2190 -10.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0610 0.9610 -10.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5120 3.2300 -8.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0120 2.8450 -9.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3470 1.8550 -6.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7780 0.7230 -8.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6190 -7.8650 -4.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3800 -6.7830 -6.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0350 -7.3160 -5.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8560 0.6010 -7.6500 N 0 3 0 0 0 0 0 0 0 0 0 0 4.4080 1.0680 -6.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 2 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 45 1 M END