PUBCHEM-ZINC06043104 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 48 0 0 1 0 0 0 0 0999 V2000 1.7790 -2.5610 -2.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7730 -1.9300 -1.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4690 -2.8100 -1.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4740 -2.1740 -0.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8350 -2.9060 -0.4830 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2750 -2.9100 -1.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8170 -2.1650 0.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1430 -0.7410 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6620 -4.3710 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8970 -5.1200 -0.0990 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6010 -5.5670 0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2320 -5.3670 2.1480 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9350 -6.2660 0.6430 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.5290 -5.5040 0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7020 -6.6360 1.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0950 -7.8330 2.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8910 -9.0350 1.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1380 -8.6680 0.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8300 -7.5130 -0.2660 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.8660 -7.8340 -0.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2580 -7.3320 -1.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9460 -6.1400 -1.9920 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6570 -1.9150 -2.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1150 -3.5330 -2.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3430 -2.7050 -3.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -1.7710 -0.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4840 -0.9460 -2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9430 -2.9630 -2.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1550 -3.7910 -1.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0300 -2.1220 0.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6390 -1.1400 -0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7650 -2.7130 0.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4160 -2.1470 1.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2840 -0.0750 0.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4690 -0.7110 -1.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9530 -0.3400 0.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9720 -4.9030 -0.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2520 -4.4140 0.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2870 -5.3680 -1.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7510 -5.7780 2.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7400 -6.8770 1.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1320 -7.5540 3.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7470 -8.1170 3.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3450 -9.8190 2.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8690 -9.4550 1.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1040 -8.3940 0.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0790 -9.5610 -0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1790 -8.3780 -2.3880 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 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 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 48 1 0 0 0 0 M CHG 1 48 -1 M END