PUBCHEM-ZINC06471079 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 0.5470 2.0410 0.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 0.5700 0.2700 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3140 0.3500 -0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2630 0.2380 0.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7400 -0.7760 0.0550 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1070 -0.2170 1.1280 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9390 -1.0810 0.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7890 -1.8350 1.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9330 -2.6420 2.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9690 -3.2960 2.2270 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 -2.7980 4.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0200 -1.5340 4.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1920 -1.1110 3.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7930 -0.8960 2.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3880 -0.0520 1.6410 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5640 -1.8590 6.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9890 -0.3990 4.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1590 -1.4130 -0.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 -2.4900 -1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6190 -3.1200 -2.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6100 -4.1030 -2.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5990 -4.3290 -4.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6780 -3.5460 -4.6870 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0540 -2.7710 -3.7130 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4370 -5.2600 -4.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6900 -5.5800 -4.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3610 -5.9000 -2.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5250 -4.8080 -1.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5990 -4.5870 -0.6670 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 2.2520 0.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1410 2.6840 -0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4940 2.3250 1.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 -2.5820 1.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5030 -3.0860 4.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0840 -3.6370 4.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6360 -0.1810 4.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9780 -1.8770 3.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3080 -2.6630 6.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0440 -0.9830 6.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7600 -2.1810 6.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 -0.6960 5.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4500 0.4980 5.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5490 -0.1120 3.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0870 -0.5140 -1.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1960 -1.7520 -0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0860 -3.2740 -0.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1830 -2.0620 -1.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8760 -6.1810 -5.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7290 -4.8260 -5.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2330 -6.4170 -4.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3620 -4.7120 -4.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8010 -6.8400 -2.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2950 -6.0170 -1.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8300 1.0150 1.4700 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 54 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 18 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 8 33 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 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 24 2 0 0 0 0 21 22 2 0 0 0 0 21 28 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 29 2 0 0 0 0 M CHG 1 54 -1 M END