CHEMBRIDGE-ZINC01113586 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 44 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -0.4900 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0120 -0.7160 -1.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4810 -1.2710 -2.8910 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8810 -1.1900 -3.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -0.7630 -2.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4140 -0.5970 -2.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8580 0.4690 -3.0590 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2500 -1.6260 -2.4290 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6670 -1.3900 -2.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4510 -2.6620 -2.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4940 -1.5160 -4.7620 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4120 -1.9310 -5.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5800 -2.0210 -5.3320 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 -2.2780 -7.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3420 -2.1770 -7.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7200 -2.5020 -8.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 -2.9280 -9.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5550 -3.0310 -9.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9480 -2.7040 -7.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5600 -3.4890 -10.2310 N 0 3 0 0 0 0 0 0 0 0 0 0 2.2150 -3.7730 -11.3640 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7310 -3.5800 -9.9090 O 0 5 0 0 0 0 0 0 0 0 0 0 2.9640 -0.5220 -0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0010 -0.5790 -1.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8390 -1.1170 -3.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5150 -2.4850 -2.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1180 -3.4730 -2.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2790 -2.9350 -1.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4380 -1.4440 -5.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0810 -1.8440 -6.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7570 -2.4240 -8.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 -3.1810 -10.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9880 -2.7810 -7.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0380 -1.4470 0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9480 -0.2520 -0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5950 0.2750 0.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 2 0 0 0 0 3 7 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 13 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 16 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 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 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 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END