PUBCHEM-ZINC06223580 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 58 0 0 1 0 0 0 0 0999 V2000 -0.3620 2.0860 1.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4520 0.6390 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 -0.1440 2.0910 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4360 -1.4880 1.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2440 -2.1720 0.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 -3.5540 0.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 -4.2600 1.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4330 -3.5950 2.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 -2.2000 2.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3330 -4.3320 3.5900 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6510 -3.6060 4.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5960 -4.8710 2.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7920 -4.1500 3.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9710 -4.6310 2.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0200 -5.8410 1.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8050 -6.5400 1.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6190 -6.0720 2.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1920 -6.3160 1.1350 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4380 -5.5640 1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2220 -7.5790 0.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4310 -6.0720 5.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4130 -6.5220 6.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4570 -5.3460 6.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3000 -4.8870 5.1200 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2460 -3.7980 5.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9010 -5.5240 4.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8070 -6.3850 3.5780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 2.4370 1.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9760 2.7310 1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6990 2.1870 2.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4950 0.3090 1.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 0.5640 0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 -1.6640 0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6250 -4.0820 -0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8200 -5.3360 1.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7960 -1.6430 3.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8340 -3.2010 3.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8630 -4.0210 2.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7480 -7.4800 1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7250 -6.6770 2.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7420 -5.4430 2.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2640 -6.0690 0.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3350 -4.5770 0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9300 -8.4110 1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5540 -7.5440 -0.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2230 -7.8110 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1260 -5.3380 5.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9700 -6.9030 5.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8890 -7.4210 6.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8710 -6.7470 7.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 -5.6240 7.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9070 -4.5420 7.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5920 -5.3810 4.4160 N 0 3 0 0 0 0 0 0 0 0 0 0 1.2620 -6.1060 3.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0810 -5.0540 4.8760 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7800 -5.5200 4.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 53 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 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 21 53 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 53 1 0 0 0 0 26 27 2 0 0 0 0 26 55 1 0 0 0 0 53 54 1 0 0 0 0 55 56 1 0 0 0 0 M CHG 1 53 1 M END