PUBCHEM-ZINC05869994 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.5430 0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 0.0140 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7450 -0.5090 1.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 -2.0390 1.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4760 -2.5390 2.4380 N 0 3 0 0 0 0 0 0 0 0 0 0 0.9020 -2.8290 3.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4080 -2.7640 4.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6800 -3.1350 5.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3330 -3.5770 6.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6330 -3.6490 5.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9290 -3.2770 4.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0880 -3.2310 3.7360 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9770 -3.4780 4.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7540 -2.7790 2.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7220 -2.5820 1.3590 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3440 -1.8430 0.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0240 -3.9220 0.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4910 -3.8300 0.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0560 -4.5420 -0.5120 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0770 -2.8440 0.9930 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1180 -2.1800 1.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4280 -2.4950 0.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9160 -1.3850 1.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2490 -1.0430 1.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0990 -1.8050 0.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6170 -2.9100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2850 -3.2610 0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5460 -3.7370 -0.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0060 1.9200 0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 1.9160 -0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5240 1.8840 0.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0210 -0.3630 0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5090 -0.3270 -0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7680 -0.1330 1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2380 -0.1680 2.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2580 -2.4150 1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2710 -2.3800 0.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2040 -2.4210 3.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6940 -3.0830 5.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -3.8660 7.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4180 -3.9930 6.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8490 -4.7590 1.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4170 -4.0240 -0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2430 -1.0990 1.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2500 -2.5300 2.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2520 -0.7900 2.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6290 -0.1800 1.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1420 -1.5350 0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9100 -4.1280 -0.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9880 -4.5280 -0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9870 -4.1800 -1.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3370 -3.1010 -1.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 14 2 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 10 2 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 21 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 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 M CHG 1 5 1 M END