PUBCHEM-ZINC06096481 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 33 0 0 1 0 0 0 0 0999 V2000 0.0160 1.4560 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0710 0.1290 -0.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0860 -0.6450 -0.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3410 -0.1010 -0.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 1.2370 0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2580 2.0100 0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5920 -0.9330 -0.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2670 -0.8700 -2.0300 S 0 0 0 0 0 0 0 0 0 0 0 0 5.7630 -1.8910 -1.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5720 -2.1510 -3.0410 C 0 0 3 0 0 0 0 0 0 0 0 0 6.8050 -1.2220 -3.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8700 -2.7700 -2.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8680 -4.0380 -2.3900 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9000 -3.0860 -3.9570 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0850 -4.0650 -3.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1210 -2.7240 -5.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9250 -1.5620 -5.3810 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4780 -3.8990 -5.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7510 -3.8570 -7.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9560 -4.0320 -7.5470 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8830 2.0590 0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0390 -0.2990 -0.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0070 -1.6730 -0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3780 1.6870 0.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3270 3.0460 0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3490 -0.5760 0.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3710 -1.9730 -0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3690 -1.3630 -1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4400 -2.8420 -1.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8500 -4.8500 -5.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4020 -3.8610 -5.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7580 -1.9470 -2.0920 O 0 5 0 0 0 0 0 0 0 0 0 0 3.7290 -3.7280 -7.9440 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 21 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 14 1 0 0 0 0 12 13 2 0 0 0 0 12 32 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 30 1 0 0 0 0 18 31 1 0 0 0 0 19 20 2 0 0 0 0 19 33 1 0 0 0 0 M CHG 1 32 -1 M CHG 1 33 -1 M END