PUBCHEM-ZINC05815565 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 -1.6930 3.2870 -0.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6620 2.2010 -1.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4640 2.2210 -0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4540 1.2540 -0.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 0.2390 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2010 0.1780 -2.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7830 1.1970 -2.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9410 1.2640 -3.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0910 -0.9410 -3.0160 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0950 -1.6940 -2.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9330 -1.6070 -2.0940 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2430 -2.6940 -4.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3990 -3.2830 -4.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7500 -3.0470 -3.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3810 -1.8030 -4.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7080 -1.6330 -3.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4210 -2.7120 -3.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7960 -3.9470 -2.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4680 -4.1160 -3.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7150 -2.4940 -2.7100 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6750 -3.3080 -3.4300 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.1900 -3.9930 -4.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5560 -2.3550 -4.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4710 -4.1760 -2.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7210 -3.9850 -2.3600 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 -3.1070 -4.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -4.0440 -5.6450 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0510 -2.3340 -4.6500 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 -1.2450 -3.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2470 -0.6160 -3.8700 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6020 4.0190 -1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7040 2.8650 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5690 3.8160 0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5760 3.0000 0.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3220 1.2790 0.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0950 -0.5250 -1.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1360 2.2980 -3.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7320 0.7270 -3.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8450 0.8550 -2.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4050 -4.0380 -5.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8550 -0.9600 -4.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1920 -0.6670 -3.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3390 -4.7780 -2.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0030 -5.0920 -3.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9510 -1.7730 -4.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3220 -2.8950 -4.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0530 -1.6320 -3.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8720 -2.5790 -5.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7690 -5.0200 -1.7820 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 29 30 2 0 0 0 0 M CHG 1 49 -1 M END