PUBCHEM-ZINC03874328 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 -0.7130 1.4910 0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4580 0.0230 0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -0.7150 1.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5190 -0.4460 2.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9330 -1.6560 3.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7800 -2.6330 2.2710 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2780 -2.1480 1.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 -2.8030 0.0510 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 -2.1020 -0.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7630 -0.7260 -0.9070 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1520 -0.2640 -1.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8790 -2.7660 -2.1370 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5750 0.8510 3.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9130 1.5680 3.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9230 2.9350 3.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1800 3.0790 5.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1750 4.3460 5.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8970 5.4830 4.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 5.3500 3.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6600 4.0830 3.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8920 6.8060 5.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6220 6.9880 6.6160 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0070 7.7290 5.1450 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8410 9.1080 5.6320 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1160 9.1420 6.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6750 10.1140 4.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1840 9.9650 5.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0470 11.0380 4.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4540 11.8600 3.5870 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 9.5630 5.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2780 8.9270 4.5620 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 2.0350 0.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0720 1.8530 -0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4780 1.7250 1.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3430 -1.8170 4.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 -3.7620 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2660 -2.3120 -2.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 1.4880 3.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4080 0.6770 4.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7350 0.9700 3.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 1.6670 2.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3880 2.2080 5.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 4.4420 6.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4700 6.2210 2.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4660 4.0020 1.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3470 7.5030 4.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4410 10.0110 3.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3850 11.1360 5.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4130 9.9860 6.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5150 8.9950 4.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2810 10.9640 4.6160 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.0390 10.4710 6.2440 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 13 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 30 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 28 29 2 0 0 0 0 28 51 1 0 0 0 0 30 31 2 0 0 0 0 30 52 1 0 0 0 0 M CHG 1 51 -1 M CHG 1 52 -1 M END