PUBCHEM-ZINC06257765 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 36 0 0 1 0 0 0 0 0999 V2000 -0.5220 1.1990 0.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -0.1560 0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9070 -0.7210 1.3340 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5350 0.0730 1.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5680 -1.1550 -0.3140 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4350 -0.6300 0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4630 0.0790 -1.0910 S 0 0 0 0 0 0 0 0 0 0 0 0 3.0270 -2.2480 -1.3100 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1550 -2.6920 -1.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0110 -1.7150 -2.3820 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7750 -1.1040 -1.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7250 -2.8680 -3.1160 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9920 -3.5310 -3.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6970 -2.3680 -4.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4220 -3.4900 -4.6910 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5900 -4.0400 -3.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4940 -3.6780 -2.2080 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9120 -3.7840 -1.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3450 -0.9020 -3.3470 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7630 -0.2730 -2.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6640 -3.3130 -0.5680 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0060 -3.5370 0.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -1.3220 2.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9230 -2.0260 3.3200 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9090 -1.1250 -0.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2040 1.9120 0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.6460 -0.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3290 1.1020 1.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1850 -1.8760 -5.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4320 -1.6770 -3.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3410 -0.7260 -1.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 -2.1070 -0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7450 -1.2920 0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8170 -1.7740 0.7810 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 -2.0510 1.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0390 -1.0110 2.7120 O 0 5 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 7 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 3 34 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 5 34 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 21 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 19 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 17 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 17 18 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 23 24 2 0 0 0 0 23 36 1 0 0 0 0 25 31 1 0 0 0 0 25 32 1 0 0 0 0 25 33 1 0 0 0 0 34 35 1 0 0 0 0 M CHG 1 36 -1 M END