PUBCHEM-ZINC03646602 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 43 0 0 1 0 0 0 0 0999 V2000 0.0450 1.5760 -0.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1170 0.1190 -0.2660 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4510 -0.4950 -0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5820 -0.3980 -0.2400 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0080 -0.2610 -1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5850 -1.9120 0.1310 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9170 -2.4320 -0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9770 -2.5990 0.1150 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5600 -2.2260 0.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8150 -4.1320 0.2860 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1530 -4.3460 1.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1550 -4.8490 0.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9180 -6.3300 0.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9040 -6.8990 0.2860 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9840 -7.1860 1.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0810 -6.5890 1.5910 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.1790 -4.6580 -0.8950 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1120 -5.6290 -0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7040 -2.3250 -1.1250 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3730 -2.8100 -1.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7920 -1.4820 -1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2880 -0.9050 -0.2310 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3560 -1.3550 -2.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0260 -2.0720 1.4510 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2220 -1.4960 1.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3960 0.3520 0.7190 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4220 0.0010 1.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1280 1.4690 0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1080 2.0000 -0.7300 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9390 2.0200 1.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4870 -0.0970 1.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 0.7190 1.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1090 1.8310 -0.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4110 1.7650 -1.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 2.2600 0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6550 -4.4400 1.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8080 -4.7430 -0.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0240 -2.1970 -2.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9160 -0.4190 -2.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5550 -1.3460 -3.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3240 1.2130 2.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3110 2.6820 2.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7880 2.5840 1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6900 -8.3920 1.6230 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 31 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 26 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 24 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 19 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 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 44 2 0 0 0 0 17 18 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 41 1 0 0 0 0 30 42 1 0 0 0 0 30 43 1 0 0 0 0 31 32 1 0 0 0 0 M CHG 1 16 -1 M END