PUBCHEM-ZINC02759029 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 0 0 0 0 0 0999 V2000 0.4120 0.7630 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3820 -0.6580 -0.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8390 -1.2560 -0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9830 -0.4910 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2240 -1.1000 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3270 -2.4720 -0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1900 -3.2400 -0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9440 -2.6360 -0.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -3.3900 -0.4600 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 -4.8000 -0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6820 -3.1300 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2460 -3.2030 -1.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5640 -3.8440 -1.4530 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2550 -4.0170 -2.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7850 -3.6420 -3.6550 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.5760 -4.6600 -2.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2850 -4.8370 -3.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4870 -5.5870 -3.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9160 -6.4850 -2.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0690 -6.9770 -3.0830 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.4450 -6.4350 -4.3170 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.2620 -6.6380 -4.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4820 -5.5770 -4.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4770 -4.7840 -5.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8350 -5.3780 -7.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8290 -4.6320 -8.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4680 -3.2950 -8.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1120 -2.6990 -7.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1200 -3.4330 -5.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4610 -2.3620 -9.7640 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -9.1290 -5.1020 -1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5680 -5.4520 -0.3340 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4450 1.1110 -0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1570 1.2240 -0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 1.0390 0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9050 0.5810 0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1140 -0.5020 0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2730 -4.3120 -0.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9620 -5.2820 -0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4950 -5.1940 0.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6290 -5.0010 -1.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5870 -4.1380 0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3550 -2.5480 0.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3410 -2.1960 -1.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5730 -3.7860 -2.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9380 -4.1430 -0.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9230 -4.4040 -4.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3800 -6.7220 -1.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1160 -6.4210 -7.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1050 -5.0900 -9.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8310 -1.6560 -7.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8470 -2.9670 -4.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 13 46 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 29 52 1 0 0 0 0 31 32 3 0 0 0 0 M END