PUBCHEM-ZINC02961756 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3700 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -0.6920 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4180 0.0250 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3700 1.4370 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 2.0850 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 3.5650 0.0100 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0730 4.1500 0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1820 4.1970 0.0030 O 0 5 0 0 0 0 0 0 0 0 0 0 3.5960 -0.8420 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2870 -2.1750 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5480 -2.4180 -0.0240 S 0 0 0 0 0 0 0 0 0 0 0 0 4.3480 -3.1300 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0970 -4.3220 -0.0580 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6250 -2.7090 -0.0640 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9130 -1.3960 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5500 -0.8970 -0.0730 S 0 0 0 0 0 0 0 0 0 0 0 0 4.9440 -0.4680 -0.0460 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1800 0.4730 -0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7120 -3.6900 -0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0770 -4.0250 -1.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7050 -5.1790 -2.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8760 -6.1650 -2.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4310 -7.4020 -2.2950 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9020 -7.2730 -0.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7220 -6.2980 -0.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.8950 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -0.5550 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2880 2.0050 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5830 -3.2750 0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3910 -4.5970 0.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2060 -4.4400 -2.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3990 -3.1180 -2.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0530 -4.2170 -3.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9250 -5.5660 -3.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2410 -6.3380 -3.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6780 -5.7530 -2.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5620 -8.2480 -0.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6760 -6.8940 -0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9260 -6.7030 -1.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3510 -6.1540 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1680 -5.0090 -1.5420 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 12 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 13 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 20 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 20 30 1 0 0 0 0 20 31 1 0 0 0 0 21 32 1 0 0 0 0 21 33 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 26 40 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M END