PUBCHEM-ZINC06453261 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 0 0 1 0 0 0 0 0999 V2000 -0.2740 1.4350 -0.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 0.0150 -0.1940 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 -0.5800 -1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9890 0.0180 -2.1890 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 -2.0270 -1.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 -2.8030 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3800 -4.1440 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2750 -4.4750 -1.5100 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2930 -2.8400 -1.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9110 -2.4140 -3.1410 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6330 -3.1860 -4.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8830 -4.3840 -3.9500 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2020 -2.3240 -5.1900 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4380 -1.5690 -5.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4450 -1.5670 -4.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6690 -2.4710 -4.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9710 -3.1930 -5.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7670 -3.9780 -6.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5080 -3.1080 -6.4840 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7110 -2.3580 -7.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2730 -3.8730 -7.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 -3.3650 -6.7020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 1.9050 -0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8480 1.7010 -1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8130 1.7960 0.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4540 -2.3920 0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -4.9460 0.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8110 -1.4170 -3.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6750 -0.7590 -5.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2510 -1.0870 -3.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5370 -1.8690 -4.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5090 -3.2040 -3.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2750 -2.4600 -6.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8200 -3.8720 -5.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0190 -4.3930 -7.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5870 -4.8410 -5.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5130 -4.8770 -7.7410 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 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 9 2 0 0 0 0 6 7 2 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 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 37 1 0 0 0 0 M CHG 1 37 -1 M END