FDA-ZINC00001245 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 35 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3660 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -0.0040 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2090 -0.6870 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4100 0.0070 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4150 1.3780 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 2.0810 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 3.4990 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3420 4.3220 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9230 5.6130 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4520 5.5700 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 4.2690 0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4020 6.6640 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7170 6.4790 0.0490 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5100 7.4900 0.1580 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1260 8.9120 0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4490 9.6370 0.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6250 10.8350 0.3800 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3890 8.6730 0.3700 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8500 7.4530 0.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4980 6.4250 0.2860 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 -2.1670 -0.0200 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0780 -2.8310 -0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3590 -2.8200 -0.0320 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9590 1.8960 0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -0.5550 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3440 -0.5350 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3520 1.9160 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3680 3.9840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5450 6.4960 0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 7.6650 0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4770 9.1230 1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6370 9.1890 -0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3400 8.8430 0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 21 1 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 9 10 2 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 19 20 2 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