PUBCHEM-ZINC06092507 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 1 0 0 0 0 0999 V2000 -0.4420 1.1260 -0.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3870 -0.2320 -0.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8450 -0.8430 -0.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0170 -0.0820 -0.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9650 1.2840 -0.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 1.8830 -0.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1800 1.9130 -0.6990 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1720 3.3320 -0.4840 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5080 3.5690 0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6150 3.7600 -0.1300 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3140 3.3700 -0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7250 5.2830 -0.0510 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2150 5.6560 0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1560 5.9390 -1.3020 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7850 5.6840 -2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7230 5.4470 -1.4990 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0840 5.7110 -0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7440 4.0200 -1.6680 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1130 6.1630 -2.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 5.5860 -3.3170 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2190 7.3610 -1.1410 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6580 7.6870 -1.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1030 5.6490 0.1110 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1240 6.6080 -0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0320 3.2220 1.1330 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8800 3.6680 1.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9390 -2.2640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2330 -2.8100 0.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3540 -4.2860 1.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0470 -5.0090 0.5920 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.3980 1.5980 -1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3070 -0.8120 -0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9820 -0.5460 -0.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6490 2.9320 -1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6370 -2.8610 -0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4420 -2.2130 1.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6290 7.3090 -2.9530 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.2850 -4.6030 2.4050 O 0 0 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 18 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 25 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 23 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 21 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 27 28 2 0 0 0 0 27 35 1 0 0 0 0 28 29 1 0 0 0 0 28 36 1 0 0 0 0 29 30 1 0 0 0 0 29 38 2 0 0 0 0 M CHG 1 30 -1 M CHG 1 37 -1 M END