PUBCHEM-ZINC05580988 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 1 0 0 0 0 0999 V2000 0.2220 -1.0550 0.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 0.1330 0.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 1.5460 0.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0930 2.2580 0.6360 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0110 3.6050 0.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2570 4.1840 0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3410 3.3220 0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3130 1.9840 0.3570 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4200 4.1300 -0.0220 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9650 5.4230 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6610 5.4940 0.1560 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7870 3.6960 -0.2460 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8620 2.6380 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3290 3.9740 -1.6620 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1100 5.0210 -1.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8280 3.8990 -1.3580 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.1770 2.8610 -1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9460 4.6030 -0.0080 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.6960 4.1030 0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6630 4.4300 0.6540 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2800 6.0930 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6410 6.5650 1.2020 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1530 8.1000 1.3410 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.4060 8.2260 3.0070 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.0290 7.4890 3.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5180 8.2490 3.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0520 8.9800 1.0180 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4450 8.2140 0.7040 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5750 4.4900 -2.4110 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1000 4.1560 -3.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0210 3.0190 -2.5230 O 0 5 0 0 0 0 0 0 0 0 0 0 2.1700 4.3500 0.5930 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3390 -2.1070 0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6260 6.2650 -0.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4160 6.6660 -0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1300 6.2620 -0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0440 3.8710 0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1100 5.3560 0.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 3 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 2 0 0 0 0 10 34 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 20 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 31 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 29 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 27 2 0 0 0 0 23 28 2 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 29 30 1 0 0 0 0 32 37 1 0 0 0 0 32 38 1 0 0 0 0 M CHG 1 31 -1 M END