PUBCHEM-ZINC06863884 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 0.3010 0.8790 -2.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 -0.4880 -2.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6020 -1.0040 -1.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5010 -0.1430 -0.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2880 1.2350 -0.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1900 1.7380 -1.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6780 -0.6900 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6830 -1.9320 0.3600 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6870 -2.4100 0.8570 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5980 -3.6690 1.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5460 -4.2720 1.2480 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7770 -4.3160 1.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9770 -3.6120 2.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0750 -4.2220 2.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9890 -5.5290 3.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8040 -6.2320 2.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6960 -5.6320 2.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7220 -7.6290 3.4380 N 0 3 0 0 0 0 0 0 0 0 0 0 7.6970 -8.1590 3.9400 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6790 -8.2500 3.3330 O 0 5 0 0 0 0 0 0 0 0 0 0 4.8490 0.1780 0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5700 0.0600 1.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6540 0.8870 1.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0120 1.7790 0.7410 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3600 1.9220 -0.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2680 1.1320 -0.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5550 1.2780 -2.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 -1.1540 -2.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7620 -2.0710 -1.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9810 1.9060 -0.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 2.8050 -1.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0450 -2.5920 1.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0030 -3.6790 2.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8520 -6.0020 3.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7700 -6.1800 2.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2820 -0.6680 2.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2160 0.8040 2.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6880 2.6660 -1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7420 1.2510 -1.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 16 2 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 36 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 38 1 0 0 0 0 26 39 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M END