PUBCHEM-ZINC06186782 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 37 0 0 1 0 0 0 0 0999 V2000 0.0310 1.2920 0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -0.1680 0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4940 -1.1290 1.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4580 -0.5350 -0.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7240 -0.3470 -1.1970 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0630 -0.1120 -1.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7480 0.2600 -0.3300 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5680 -0.3560 -2.5510 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7460 -0.8700 -3.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 -0.0730 -2.8430 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3710 0.6120 -2.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8570 -1.3520 -2.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9230 -1.9180 -1.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0720 -3.3350 -1.2720 S 0 0 0 0 0 0 0 0 0 0 0 0 5.4140 -4.4960 -1.9570 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9060 -3.5980 0.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2340 0.6660 -4.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1440 1.9270 -4.1350 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0310 1.5920 0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2450 1.9670 -0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6530 1.4630 1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1610 -1.1150 2.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5430 -2.1540 0.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5020 -0.8730 1.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8410 0.1080 -1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5210 -1.5640 -0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1220 -0.4390 0.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5600 -0.0600 -4.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2730 -1.6870 -4.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7840 -1.2520 -3.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4690 -2.1200 -3.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8750 -1.1250 -3.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2900 -1.1590 -0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9430 -2.2700 -1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8590 -3.7810 0.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5040 -4.4690 0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2750 -2.7200 1.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4710 -0.0680 -5.1980 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 M CHG 1 38 -1 M END