PUBCHEM-ZINC04774087 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 43 0 0 1 0 0 0 0 0999 V2000 -0.6720 1.8590 -0.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7460 0.0510 -0.4030 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -0.3870 -1.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 -1.6930 -2.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5370 -2.9650 -1.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1740 -3.5040 -0.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4130 -4.8130 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 -5.5530 -0.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3690 -5.1620 -2.2000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1350 -3.8550 -2.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4680 -3.1800 -3.5650 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0330 -1.8820 -3.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 -0.9550 -4.4300 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6750 0.2350 -4.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1150 0.5680 -2.9000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1820 -3.7710 -4.6900 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1720 -4.8620 -4.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6120 -3.2320 -4.9250 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5800 -2.1330 -4.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7830 -3.6550 -6.3900 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9890 -4.7310 -6.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4140 -3.3620 -6.9920 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1610 -4.0970 -7.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4450 -3.5230 -5.9220 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2710 -1.9580 -7.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9300 -1.7730 -8.0440 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3750 -2.0750 -7.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8610 -2.9520 -6.9910 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5190 -2.9440 -6.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5220 -3.8540 -4.1920 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.4160 -2.7970 0.7520 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3590 2.1990 -0.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2920 2.2340 -1.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0540 2.2770 0.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1580 -6.5970 -0.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7480 1.0250 -4.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4700 -1.1800 -6.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9430 -1.8120 -8.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6390 -1.8160 0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6190 -3.2920 1.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 15 2 0 0 0 0 4 5 1 0 0 0 0 4 12 2 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 24 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 30 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 28 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 25 37 1 0 0 0 0 25 38 1 0 0 0 0 26 27 1 0 0 0 0 28 29 1 0 0 0 0 31 39 1 0 0 0 0 31 40 1 0 0 0 0 M CHG 1 30 -1 M END