PUBCHEM-ZINC04544094 MOE2007 3D CORINA 3.40 0006 02.08.2006 63 67 0 0 1 0 0 0 0 0999 V2000 0.0140 1.7430 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1630 0.2300 0.2390 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0860 0.0340 1.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5560 0.3270 1.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0790 -0.4830 -0.1190 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0870 -1.5420 0.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5210 -0.1160 -0.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5330 -0.4410 0.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8660 -0.1200 0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2000 0.5230 -0.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2200 0.8480 -1.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8720 0.5380 -1.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8490 0.8530 -2.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 0.8700 -2.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1430 -0.3980 -1.3600 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4030 -1.2400 -2.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6960 -0.6400 -0.9170 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7150 -1.6800 -0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4330 -0.6220 -1.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7090 -0.5860 -1.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2430 -0.4130 0.3870 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1410 -1.4000 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1190 0.3970 1.1590 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3640 -0.2430 1.4700 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8770 -0.5420 0.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1920 0.8080 2.2300 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.3650 1.7030 1.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5100 0.1950 2.7160 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.1430 -0.0530 1.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2350 -1.0690 3.5480 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.1770 -1.5250 3.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3810 -2.0200 2.7070 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.9190 -2.3010 1.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1490 -1.3800 2.3080 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1380 -3.3380 3.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9410 -3.6640 3.7130 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5430 -0.6620 4.7420 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7680 -0.1320 4.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2160 1.1500 3.5110 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6720 1.2400 4.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4200 1.2400 3.3800 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5080 1.3430 3.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5150 0.8160 -1.1750 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 2.2630 -0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 1.9440 -0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 2.2420 0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7710 0.6730 2.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0170 -1.0000 1.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6940 1.4000 0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1630 0.0990 1.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2830 -0.9540 1.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6390 -0.3740 0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4890 1.3380 -2.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0660 1.8310 -3.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9360 0.1010 -3.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2930 1.7690 -1.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7280 0.9530 -3.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 0.2600 -2.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4110 -1.5060 -2.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3680 0.2310 -1.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2780 -1.5160 -1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5980 1.2630 -2.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2000 -3.9820 3.7370 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 44 1 0 0 0 0 1 45 1 0 0 0 0 1 46 1 0 0 0 0 2 3 1 0 0 0 0 2 17 1 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 47 1 0 0 0 0 3 48 1 0 0 0 0 4 5 1 0 0 0 0 4 49 1 0 0 0 0 4 50 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 15 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 51 1 0 0 0 0 9 10 1 0 0 0 0 9 52 1 0 0 0 0 10 11 2 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 53 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 54 1 0 0 0 0 13 55 1 0 0 0 0 14 15 1 0 0 0 0 14 56 1 0 0 0 0 14 57 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 58 1 0 0 0 0 19 59 1 0 0 0 0 20 21 1 0 0 0 0 20 60 1 0 0 0 0 20 61 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 34 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 41 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 39 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 37 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 35 1 0 0 0 0 35 36 2 0 0 0 0 35 63 1 0 0 0 0 37 38 1 0 0 0 0 39 40 1 0 0 0 0 41 42 1 0 0 0 0 43 62 1 0 0 0 0 M CHG 1 63 -1 M END