PUBCHEM-ZINC03802759 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 49 0 0 0 0 0 0 0 0999 V2000 0.0470 1.3870 0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2560 -0.1250 0.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2210 -2.0130 -1.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7050 -1.6780 -1.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6160 -0.2400 -1.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3870 0.7590 -0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5260 2.3270 0.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2200 2.2460 -0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8580 2.9290 -1.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3280 4.3680 -1.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8260 4.4610 -0.0590 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6700 -1.6080 0.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8010 -2.6580 0.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9730 -2.2000 0.7510 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2320 0.0230 -2.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2550 0.2130 -2.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9790 -0.5280 -2.1130 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8930 1.5310 0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3730 1.8090 -0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5320 -0.6560 0.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1830 -0.3430 0.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0860 -2.5680 -0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 -2.6400 -2.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7340 -1.1570 -2.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2490 -2.6150 -1.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3090 -1.0260 -1.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3320 0.2860 -2.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3990 0.8910 -0.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5030 0.4380 0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5610 1.5780 1.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6080 3.3130 1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2620 1.3900 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0980 3.1330 -0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6220 2.4450 -2.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8980 2.8760 -2.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9320 -0.9080 1.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7600 -2.1050 1.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7870 0.9530 -2.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6900 -0.5760 -3.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3180 -0.7990 -1.1840 N 0 3 0 0 0 0 0 0 0 0 0 0 0.6740 -1.1600 -1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4000 -0.8500 -0.5130 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7730 2.1390 -0.1860 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.4580 2.7360 0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0660 2.1680 0.7560 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7390 3.1140 0.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1600 5.2100 -2.1420 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.4150 -3.8420 0.3880 O 0 5 0 0 0 0 0 0 0 0 0 0 1.5400 1.0090 -3.7880 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 45 1 0 0 0 0 2 20 1 0 0 0 0 2 21 1 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 3 40 1 0 0 0 0 4 24 1 0 0 0 0 4 25 1 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 5 27 1 0 0 0 0 5 42 1 0 0 0 0 6 28 1 0 0 0 0 6 29 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 7 43 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 8 45 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 9 43 1 0 0 0 0 10 11 2 0 0 0 0 10 47 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 12 42 1 0 0 0 0 13 14 2 0 0 0 0 13 48 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 49 1 0 0 0 0 40 41 1 0 0 0 0 43 44 1 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 40 1 M CHG 1 43 1 M CHG 1 47 -1 M CHG 1 48 -1 M CHG 1 49 -1 M END