PUBCHEM-ZINC06520142 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 0 0 0 0 0 0999 V2000 0.3980 0.6300 -0.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -0.7920 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0810 -1.7710 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2260 -1.4780 -0.3110 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7740 -3.0370 0.3330 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4680 -3.7150 0.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 -3.3700 0.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7410 -4.5180 0.9730 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4690 -2.4510 0.6630 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -1.1460 0.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4860 0.0580 0.3280 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.3980 -0.4630 -1.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6140 0.1350 -1.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3270 -0.2760 -2.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8300 -1.2820 -3.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6200 -1.8800 -3.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9000 -1.4700 -1.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5960 -1.7200 -4.4970 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.6630 -1.1940 -4.7620 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1600 -2.6060 -5.2100 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.8330 -2.8420 1.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9120 -3.0240 2.4440 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 -1.8040 3.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0790 -2.1180 4.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8590 -2.7300 5.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4590 0.7110 -0.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 0.9140 -1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 1.2920 0.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0030 0.9210 -0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2720 0.1890 -2.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2350 -2.6660 -3.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9520 -1.9340 -1.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5290 -2.0600 0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0910 -3.7740 0.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1170 -1.1950 2.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8930 -1.2580 2.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2350 -1.1950 5.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9100 -2.7990 4.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8380 -2.9570 6.0420 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 10 2 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 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 17 32 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 21 22 1 0 0 0 0 21 33 1 0 0 0 0 21 34 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 35 1 0 0 0 0 23 36 1 0 0 0 0 24 25 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 25 39 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M END