CHEMBRIDGE-ZINC04857472 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 -0.6590 2.1610 0.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 0.6410 0.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8810 -0.0130 0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7320 -1.4330 0.4470 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8710 -2.1700 0.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7970 -3.5550 0.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9520 -4.3050 0.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1930 -3.6720 0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2640 -2.2810 0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1060 -1.5360 0.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4360 -4.4760 0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5110 -4.1790 0.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6350 -4.9060 0.8640 N 0 3 0 0 0 0 0 0 0 0 0 0 -8.7140 -5.9180 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6360 -6.2100 -0.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5210 -5.4810 -0.7540 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.5760 -5.7370 -1.4780 O 0 5 0 0 0 0 0 0 0 0 0 0 -7.7240 -7.3290 -1.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7770 -8.3510 -1.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8620 -9.3910 -2.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8880 -9.4200 -3.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8310 -8.4060 -3.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7570 -7.3660 -2.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9670 -10.4400 -4.4920 F 0 0 0 0 0 0 0 0 0 0 0 0 -9.9750 -6.7380 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7350 -4.6060 1.7030 O 0 5 0 0 0 0 0 0 0 0 0 0 -7.4180 -3.0410 1.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3240 2.6270 0.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1730 2.5110 -0.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2420 2.4280 1.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 0.3740 -0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 0.2910 1.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4640 0.2540 1.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3940 0.3370 -0.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8350 -4.0450 0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8940 -5.3820 0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2240 -1.7870 0.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1600 -0.4590 0.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9770 -8.3290 -1.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1280 -10.1830 -2.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6290 -8.4320 -4.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4960 -6.5780 -2.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6790 -6.2480 -0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7370 -7.7300 -0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4230 -6.8280 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7610 -2.1220 1.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0410 -3.2570 2.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3820 -2.9200 2.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 14 15 2 0 0 0 0 14 25 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 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 M CHG 1 13 1 M CHG 1 16 1 M CHG 1 17 -1 M CHG 1 26 -1 M END