PUBCHEM-ZINC05696095 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 1 0 0 0 0 0999 V2000 -0.0220 1.5030 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.0040 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 -0.6760 -0.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0830 -2.0560 -0.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7710 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 -2.0930 0.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0380 -0.7120 0.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -4.1680 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1930 -4.9480 1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 -6.0950 0.9650 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1360 -5.6860 0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6210 -7.0070 -0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 -6.1870 -1.2780 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0500 -4.8940 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4170 -4.4200 -2.4310 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6520 -3.5040 -2.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3930 -5.4630 -3.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -6.5840 -2.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 -7.8850 -3.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4710 -8.8890 -2.6080 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1480 -7.9010 -4.5380 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5170 -6.7990 -5.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7520 -6.9040 -6.3950 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6660 -5.5790 -4.6360 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0780 -4.4160 -5.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -9.1680 -5.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3930 -9.8920 -5.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2880 -11.1950 -5.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2440 -11.5120 -6.4880 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 -6.8490 2.1660 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 1.8630 -0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 1.8540 0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 1.8810 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8710 -0.1200 -1.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9110 -2.5800 -1.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8360 -2.6450 1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8620 -0.1840 1.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5740 -4.3080 2.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 -5.3530 1.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3920 -7.7090 -0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2380 -7.5570 0.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1960 -3.9260 -5.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7270 -4.7410 -6.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6170 -3.7160 -4.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2260 -8.9690 -6.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -9.7920 -4.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6650 -10.0900 -4.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1570 -9.2670 -5.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7070 -6.3340 2.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3560 -12.0030 -6.0640 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2400 -12.8280 -6.5550 H 0 0 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 8 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 30 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 24 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 28 29 2 0 0 0 0 28 50 1 0 0 0 0 30 49 1 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 13 1 M END