CHEMDIV-ZINC01458585 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 0.4860 1.0030 1.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3810 -0.4680 0.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5330 -1.2640 0.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4410 -2.6290 0.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1970 -3.2130 0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9560 -2.4190 0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 -1.0550 0.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1070 -4.6310 -0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 -5.4790 0.9820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -5.0560 -1.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1320 -6.4870 -1.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3300 -6.6430 -3.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5310 -7.7110 -3.6810 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2680 -5.3750 -3.6710 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 -4.3170 -2.6870 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8910 -3.6580 -2.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -3.5390 -2.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 -2.1370 -3.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3500 -1.4020 -3.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5590 -2.0570 -3.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6230 -3.4460 -3.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4790 -4.1840 -3.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 -5.1050 -5.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9000 -4.6470 -5.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1010 -4.3940 -6.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0250 -2.7690 -6.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8330 -4.1990 -8.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1260 -7.3830 -0.8310 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 1.5490 0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4190 1.3750 1.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3280 1.2160 1.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5110 -0.8270 0.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3480 -3.2300 0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9330 -2.8570 0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7690 -0.4540 0.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2720 -1.6020 -2.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3050 -0.3170 -3.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4520 -1.4840 -3.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5680 -3.9560 -3.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5580 -5.2670 -3.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2540 -4.3550 -5.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2700 -6.0270 -5.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6050 -5.4090 -5.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1020 -3.7360 -4.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5020 -3.5510 -7.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8380 -5.2910 -7.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3920 -1.9780 -7.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9670 -2.7980 -5.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0670 -2.6300 -6.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5610 -5.2070 -8.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2400 -3.4430 -9.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9030 -4.0380 -8.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -6.4050 0.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5530 -4.0930 -7.1520 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.1210 -4.8230 -6.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 9 53 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 28 2 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 54 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 26 54 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 54 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END