PUBCHEM-ZINC05167427 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 35 0 0 1 0 0 0 0 0999 V2000 -0.0250 1.4750 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4660 0.0410 -0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4530 -0.3840 0.4740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 -0.7090 -0.9050 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 -0.3200 -1.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1740 -2.1300 -1.2340 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3730 -2.6180 -0.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 -2.3400 -2.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2510 -1.7410 -2.6120 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.8500 -2.5260 -4.1660 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6610 -3.5980 -4.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0830 -2.0910 -5.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1240 -0.6880 -5.6790 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0400 -0.4610 -5.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3560 -2.3570 -4.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1370 -3.4740 -4.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5150 -3.3520 -4.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1330 -2.1110 -4.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3760 -0.9910 -4.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9970 -1.1120 -4.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5380 -2.8400 -1.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4930 -2.0550 -1.7520 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7010 1.5590 0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 1.8260 -0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8920 2.1050 0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -1.8070 -3.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5370 -3.4040 -2.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0300 -2.3800 -5.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4870 -2.5950 -6.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6790 -4.4540 -4.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1050 -4.2270 -5.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2060 -2.0180 -4.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8590 -0.0240 -4.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4300 -0.2240 -3.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5330 -4.0960 -1.3310 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 21 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 15 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 18 19 2 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 20 34 1 0 0 0 0 21 22 2 0 0 0 0 21 35 1 0 0 0 0 M CHG 1 35 -1 M END