CHEMBRIDGE-ZINC00472089 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 0 0 0 0 0 0999 V2000 0.2010 1.1330 1.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 -0.2020 0.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2770 -0.7110 0.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1540 -0.0700 1.2170 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5720 -1.8800 0.0740 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8680 -2.4010 0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9620 -1.5450 0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2430 -2.0590 0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4390 -3.4250 0.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3480 -4.2860 0.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0620 -3.7730 0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5470 -5.6690 0.3810 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6180 -6.5120 -0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6570 -6.0720 -0.7140 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7660 -7.9700 0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9100 -8.4960 1.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0470 -9.8580 1.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0420 -10.7010 0.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8990 -10.1860 -0.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7670 -8.8260 -1.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6210 -8.2760 -2.3870 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.7050 -9.0140 -3.3520 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4160 -7.0860 -2.5460 O 0 5 0 0 0 0 0 0 0 0 0 0 -7.0500 -4.0660 0.4080 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2270 1.5010 1.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4430 1.8570 0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1380 0.9920 2.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4800 -0.0610 -0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7850 -0.9260 1.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 -2.3600 -0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8120 -0.4770 0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0920 -1.3910 0.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2130 -4.4400 0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3540 -6.0220 0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9140 -7.8380 2.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1590 -10.2660 2.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1500 -11.7670 0.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8960 -10.8500 -1.6850 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 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 2 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 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END