PUBCHEM-ZINC05818931 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 58 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 0.0090 -2.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1540 0.0320 -1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -2.0040 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3390 -2.6800 -2.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3650 -4.0610 -2.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7880 -4.7820 -1.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1800 -4.1020 -0.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1650 -2.7040 -0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3910 -4.8010 0.7890 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9500 -4.1720 1.7670 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5210 -4.8720 2.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5020 -6.2700 2.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0800 -6.9690 3.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6780 -6.2910 4.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7010 -4.9080 4.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1220 -4.1940 3.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1430 -2.7140 3.8760 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.6670 -2.1250 4.8040 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6360 -2.0860 2.9640 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8130 -6.1390 -1.3180 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0200 -4.7860 -3.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5720 -3.7660 -4.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1640 -5.6510 -2.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 -5.6750 -4.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6540 -6.4100 -5.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 1.0990 -2.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4880 -0.3420 -3.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0440 -0.3680 -2.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6810 -0.3290 -0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6640 -0.3190 -2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1390 1.1220 -1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7890 -2.1240 -3.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2980 -2.1730 0.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0360 -6.8000 1.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0660 -8.0490 3.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1300 -6.8440 5.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1700 -4.3850 5.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5890 -6.5240 -0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3060 -3.1320 -3.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0460 -4.2900 -5.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7560 -3.1490 -4.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7710 -6.3780 -2.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6380 -6.1750 -3.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8990 -5.0180 -2.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5950 -6.4010 -3.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1730 -5.0580 -4.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0470 -5.6840 -6.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4690 -7.0270 -4.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9190 -7.0440 -5.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 24 1 0 0 0 0 9 10 2 0 0 0 0 9 23 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 41 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 17 18 2 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END