FDA-ZINC00057235 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 1 0 0 0 0 0999 V2000 0.0720 1.8860 -0.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 0.3610 -0.0860 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9840 0.0660 0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8180 -0.0330 1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3270 0.1130 1.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8110 -0.6520 -0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0360 -0.2690 -1.4580 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2810 0.7680 -1.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 -0.4050 -1.2360 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1640 -0.1570 -2.3970 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0520 -1.1160 -2.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 -2.2260 -2.3810 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7900 -0.7220 -4.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3410 0.5560 -4.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0130 0.9080 -5.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1380 -0.0060 -6.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5940 -1.2880 -6.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9290 -1.6520 -5.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6860 -2.5020 -7.6360 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.0250 -1.7920 -8.7260 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9260 -3.6340 -7.1100 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2280 -2.8220 -7.8560 N 0 5 0 0 0 0 0 0 0 0 0 0 -4.6420 -1.9750 -8.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9820 0.5480 -7.8340 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.5200 -1.1710 -2.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 2.2810 -0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 2.1820 -1.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3190 2.3870 0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 0.5680 2.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5850 -1.0780 1.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6000 1.1710 0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8290 -0.2670 1.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8810 -0.4620 -0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7050 -1.7290 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 0.7210 -2.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2770 1.2800 -3.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4420 1.9040 -5.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5040 -2.6480 -5.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2560 -2.2200 -2.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0890 -0.8690 -3.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6090 -1.1120 -2.7070 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 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 25 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 M CHG 1 22 -1 M END