PUBCHEM-ZINC05390272 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 41 0 0 1 0 0 0 0 0999 V2000 -0.1790 1.4460 -0.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2230 0.1260 -0.6190 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9410 -0.5510 -0.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1620 0.1480 -0.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5690 -0.1470 -0.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2170 1.0580 -0.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5790 1.2520 -0.6070 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9630 2.2170 -0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3910 0.1730 -0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0490 0.3040 -0.2710 S 0 0 0 0 0 0 0 0 0 0 0 0 5.7760 -1.0560 -0.2390 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3830 -1.8480 -0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4130 -1.3040 -0.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8260 -2.8440 -0.1150 S 0 0 0 0 0 0 0 0 0 0 0 0 3.3160 2.0510 -0.9930 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0500 1.5250 -0.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9020 2.2210 -0.9800 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7130 3.4080 -1.3880 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2460 3.2870 -2.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5530 4.1490 -0.3150 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1540 3.8820 0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1410 5.5980 -0.5960 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6750 6.0190 -1.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6670 5.4600 -0.9440 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3330 6.2690 -1.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5610 4.2270 -1.6860 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7220 5.3790 0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4330 4.9540 -0.2000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 4.1310 -0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3980 6.4200 0.5310 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2700 6.0930 0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8540 4.0020 -0.5350 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8270 -1.8980 -0.2560 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1380 1.9460 -0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0500 4.6450 0.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6180 6.3500 0.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 -2.2780 -0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6430 -2.4860 -0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 2 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 16 2 0 0 0 0 5 6 2 0 0 0 0 5 13 1 0 0 0 0 6 7 1 0 0 0 0 6 15 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 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 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 26 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 32 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 30 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 27 28 1 0 0 0 0 27 35 1 0 0 0 0 27 36 1 0 0 0 0 28 29 1 0 0 0 0 30 31 1 0 0 0 0 33 37 1 0 0 0 0 33 38 1 0 0 0 0 M CHG 1 32 -1 M END