PUBCHEM-ZINC05112973 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 35 0 0 1 0 0 0 0 0999 V2000 0.0700 1.4730 0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 -0.0250 -0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5900 -0.4350 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 0.3680 0.2200 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7710 -1.7960 -0.0410 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9840 -2.4250 -0.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0870 -2.4370 0.0480 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7610 -1.9230 -0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6640 -2.3840 1.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7470 -2.9150 2.4230 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9060 -2.4430 2.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9170 -3.8890 -0.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8020 -4.3920 -0.5740 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0930 -4.5520 -0.6690 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1660 -5.9430 -1.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6220 -6.4130 -1.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4910 -5.5220 -1.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5240 1.9000 -0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1920 1.2780 0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7790 3.3890 0.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 3.9220 -0.6320 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5550 2.0530 -0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2920 1.7220 1.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 -0.3010 -1.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4670 -0.6020 0.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8840 -1.3530 1.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5940 -2.9560 1.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0170 -4.1310 -0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6170 -6.0240 -2.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6690 -6.5660 -0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7630 -7.6080 -1.6950 O 0 5 0 0 0 0 0 0 0 0 0 0 1.3660 3.8260 1.4410 O 0 5 0 0 0 0 0 0 0 0 0 0 1.9920 1.7430 -1.4470 N 0 3 0 0 0 0 0 0 0 0 0 0 2.4520 2.7050 -1.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2450 1.7210 -2.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7030 1.0250 -1.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 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 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 28 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 2 0 0 0 0 16 31 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 33 1 0 0 0 0 20 21 2 0 0 0 0 20 32 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 33 36 1 0 0 0 0 M CHG 1 31 -1 M CHG 1 32 -1 M CHG 1 33 1 M END