PUBCHEM-ZINC03598444 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 55 0 0 1 0 0 0 0 0999 V2000 2.9890 0.3800 -1.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7750 0.4380 -0.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0670 -0.3520 0.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6990 -0.6740 0.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 -0.9650 -0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2290 0.2290 -2.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4830 -0.1190 -3.8770 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3080 0.5680 -4.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4670 -0.1380 -5.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3090 -0.5090 -6.2170 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4850 -0.5310 -7.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4090 -0.9180 -8.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 -0.9880 -9.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4530 0.1340 -10.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1810 0.0710 -11.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8240 -1.1110 -12.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7420 -2.2300 -11.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0140 -2.1700 -10.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0590 -1.4310 -3.6940 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 -1.7150 -4.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5730 -0.3350 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3140 -2.4710 -0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3930 1.8930 -0.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2080 -0.6430 -2.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8560 1.0030 -2.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8810 0.7560 -1.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5990 -1.2850 0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6790 0.2100 1.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7430 -1.5160 1.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3260 0.1870 1.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4030 1.2970 -2.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1890 -0.2940 -2.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 -0.8870 -4.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9150 0.8500 -5.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2980 -1.2570 -7.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 0.4610 -7.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2380 -0.2040 -8.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8930 -1.8830 -8.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 1.0640 -10.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2460 0.9450 -12.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3910 -1.1590 -13.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2450 -3.1510 -11.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 -3.0500 -9.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5280 0.7590 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2880 -0.6410 -0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9990 -0.6530 0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8330 -2.9670 0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8810 -2.6700 -1.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6690 -2.9450 -0.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2550 2.4680 -1.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4740 1.9810 0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1890 2.3900 0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 -0.3440 -1.4160 N 0 3 0 0 0 0 0 0 0 0 0 0 1.0180 -1.1500 -1.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 53 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 21 1 0 0 0 0 5 22 1 0 0 0 0 5 53 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 6 53 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 19 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END