PUBCHEM-ZINC05433503 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 59 0 0 1 0 0 0 0 0999 V2000 -0.1650 1.3410 -0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -0.1750 0.0520 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6050 -0.5360 -0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 -0.5320 1.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2180 -0.3050 2.5390 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5240 -0.9690 2.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2470 -0.6670 1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3700 -0.8230 -0.0520 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6720 -1.4920 -1.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8290 -1.7070 -2.1070 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9780 -1.8900 -1.3900 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4180 -2.6900 -2.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1750 -4.1730 -2.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8930 -2.4270 -2.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2580 0.4500 3.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3680 0.9970 3.5890 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5860 0.6180 4.8600 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1050 -0.3070 5.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5350 1.8120 4.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3380 2.0820 5.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4310 1.3590 6.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8670 1.9060 7.5450 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6600 1.5810 8.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0700 2.9700 7.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1120 3.1200 6.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1740 4.1670 7.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2230 5.0130 8.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1870 4.8320 9.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1320 3.8070 9.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8240 1.8110 -0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6440 1.5740 -1.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7620 1.8070 0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8960 -1.6010 1.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5950 0.0140 1.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3280 -2.0460 2.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1710 -0.6970 3.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1230 -1.3160 1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6030 0.3690 1.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6780 -1.6270 -0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8330 -2.3920 -3.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7250 -4.5110 -1.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4920 -4.7820 -3.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1120 -4.3700 -2.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0640 -1.3640 -3.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2290 -2.9970 -3.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5230 -2.7040 -1.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9670 2.7080 4.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2220 1.6310 3.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9420 0.5060 5.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4210 4.3350 6.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 5.8240 8.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2110 5.5010 9.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8870 3.6730 9.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3700 0.8780 6.0070 N 0 3 0 0 0 0 0 0 0 0 0 0 1.0890 1.5420 5.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8750 0.0190 6.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 1.2530 6.8500 H 0 0 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 8 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 15 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 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 39 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 40 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 16 2 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 17 54 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 21 2 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 53 1 0 0 0 0 54 55 1 0 0 0 0 54 56 1 0 0 0 0 54 57 1 0 0 0 0 M CHG 1 54 1 M END