PUBCHEM-ZINC05870476 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 59 0 0 1 0 0 0 0 0999 V2000 0.5540 0.2920 0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4280 -1.2060 0.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0500 -1.5970 0.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1760 -3.0960 0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5920 -3.4700 0.1320 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2670 -3.4210 -1.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7120 -3.0690 -2.0610 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6800 -3.8000 -1.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2620 -4.1920 0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5650 -4.4880 -0.1220 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2320 -4.7910 0.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7580 -4.2780 -1.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6360 -3.8680 -2.0040 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.4860 -3.5480 -3.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8700 -3.2920 -4.0340 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.2640 -2.3490 -3.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8180 -4.4340 -3.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9360 -4.4530 -2.1750 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.1670 -4.6370 -1.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7300 -3.6050 -0.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9460 -3.7910 -0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6040 -5.0020 -0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0470 -6.0320 -1.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8330 -5.8510 -1.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9310 -5.2020 0.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7550 -3.2220 -5.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4960 -4.2130 1.2980 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1980 -3.8630 1.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5530 -3.8990 2.2950 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1010 -4.6270 2.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6070 0.5710 0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 0.8530 -0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 0.5200 1.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8860 -1.4350 -0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9350 -1.7670 1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5080 -1.3690 1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5570 -1.0360 -0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7180 -3.3240 -0.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6690 -3.6570 0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8700 -2.6570 -3.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0130 -4.3860 -3.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7980 -4.2660 -4.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4120 -5.3840 -3.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2160 -2.6590 -0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3840 -2.9890 0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5630 -6.9770 -1.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4010 -6.6540 -2.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7360 -4.9110 -0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0460 -6.2510 0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9710 -4.5870 1.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3620 -4.1650 -5.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7400 -3.0400 -5.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0820 -2.4100 -5.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9900 -5.7040 2.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6040 -4.1150 3.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1600 -4.3690 2.5650 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 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 26 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 24 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 27 28 1 0 0 0 0 27 30 1 0 0 0 0 28 29 2 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 M CHG 1 13 1 M END