PUBCHEM-ZINC00254687 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 55 0 0 0 0 0 0 0 0999 V2000 2.7270 -0.1410 -0.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2860 0.1710 -2.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8370 0.3880 -2.1230 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2890 1.7110 -1.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 2.5270 -3.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -0.6310 -2.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4570 -1.7480 -2.6010 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4400 -0.3900 -2.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1620 0.1310 -1.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5220 0.3540 -1.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1710 0.0620 -2.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4660 -0.4520 -3.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0990 -0.6770 -3.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3880 -1.1900 -4.8410 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4780 -0.2970 -6.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 -0.8170 -7.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0040 -2.2330 -7.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9480 -3.1320 -6.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8450 -2.5450 -5.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2470 0.8760 -0.5280 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9250 0.5270 0.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9550 -0.1720 0.9400 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7680 1.0060 1.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2270 0.5070 3.1120 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9560 0.9050 4.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4730 0.6970 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 -1.0390 -0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8050 -0.3020 -0.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7940 1.0690 -2.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5410 -0.6670 -2.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.6010 -1.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9480 2.2260 -1.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4820 2.0130 -3.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2310 3.5120 -2.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 2.6370 -3.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6610 0.3580 -0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2320 0.2380 -2.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9770 -0.6770 -4.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5080 -0.2650 -6.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1620 0.7060 -5.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6480 -0.1620 -7.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4630 -0.8360 -6.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0230 -2.2090 -7.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3330 -2.6240 -8.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2970 -4.1320 -6.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -3.1870 -5.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7960 -3.1750 -4.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8740 -2.5030 -5.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9820 1.4890 -0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7700 2.0960 1.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7890 0.6420 1.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4820 0.4860 5.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9630 1.9920 4.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9810 0.5390 4.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 20 1 0 0 0 0 11 12 2 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 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 18 46 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 25 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 M END