PUBCHEM-ZINC06350967 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 0 0 0 0 0 0999 V2000 0.0500 1.4200 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -0.1010 0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2280 -0.6620 0.1050 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.8710 -1.0680 -1.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -1.0930 -2.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4090 -1.5770 -3.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6560 -2.0410 -2.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0200 -2.0230 -1.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1360 -1.5400 -0.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1930 -1.3900 0.7510 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0030 -0.8550 1.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0550 -0.7100 2.5200 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3520 -0.3520 3.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2960 -1.1700 2.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9850 -1.5750 1.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3790 -2.1480 1.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3880 -1.0390 1.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7870 -1.5810 1.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9600 -2.7360 2.0170 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7760 -1.1980 4.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9680 -1.7250 5.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4210 -1.7490 6.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6750 -1.2520 6.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4820 -0.7280 5.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0370 -0.6930 4.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0560 1.8380 0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4160 1.6670 -0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 1.8380 0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 -0.5190 -0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5900 -0.3480 1.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5490 -0.7330 -2.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1360 -1.5950 -4.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3460 -2.4180 -3.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9930 -2.3850 -1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4560 -2.9290 1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5920 -2.5710 2.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2480 -0.2160 2.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2340 -0.6800 0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9890 -2.1140 5.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7960 -2.1570 7.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0250 -1.2730 7.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4600 -0.3420 6.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6660 -0.2800 3.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8420 -0.7810 1.4820 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7200 -1.1740 1.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 11 2 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 44 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 3 1 M END