PUBCHEM-ZINC03112945 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.6970 1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0760 1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7740 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0720 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6740 -1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -2.9940 -2.1960 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -4.1990 -1.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -4.1160 -0.3120 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -4.8610 0.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -5.4560 -2.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -5.4180 -3.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -6.6090 -4.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -7.8350 -3.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -7.8710 -2.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -6.6910 -1.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1010 -6.7320 -0.4350 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -6.5780 -5.9400 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8380 -7.3500 -6.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 -7.3160 -8.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6820 -8.1430 -8.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6620 -8.1070 -10.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 -7.2540 -10.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -6.4330 -10.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 -6.4620 -8.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7800 -7.2210 -12.3380 N 0 3 0 0 0 0 0 0 0 0 0 0 1.5300 -7.9420 -12.9710 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -6.4720 -12.9220 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1530 2.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6100 2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.1240 -2.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -4.4700 -4.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -8.7570 -4.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 -8.8210 -2.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7760 -6.7580 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5130 -8.0140 -6.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3600 -8.8080 -8.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3260 -8.7440 -10.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7320 -5.7710 -10.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7230 -5.8230 -8.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 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 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 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 36 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 40 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 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 26 44 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M END