PUBCHEM-ZINC02548516 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 55 0 0 0 0 0 0 0 0999 V2000 0.2150 0.9020 0.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2820 1.1840 3.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7280 3.0860 1.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5570 3.4770 0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7170 4.9970 0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5870 5.3910 -1.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7370 6.8310 -1.0770 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5620 7.4010 -2.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7520 8.7980 -2.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1420 9.7650 -1.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4010 11.1260 -1.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2700 11.5460 -2.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8730 10.6020 -3.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6290 9.2410 -3.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2460 8.4080 -3.9500 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0010 7.0990 -3.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1800 6.5630 -2.9010 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6840 6.1740 -4.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1720 6.4370 -6.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6820 6.1190 -8.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5990 4.1280 -7.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1740 0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 1.2960 0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1800 1.0990 -0.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 1.5660 3.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3100 0.0940 3.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0120 1.6140 3.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3020 3.4540 1.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1980 3.4810 2.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0820 3.1160 -0.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5470 3.0080 0.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1700 5.3780 1.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7300 5.4700 0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1220 5.0280 -1.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5680 4.9110 -0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2420 7.4090 -0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4570 9.4750 -0.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9260 11.8540 -0.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4820 12.6040 -2.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5550 10.9430 -4.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4970 5.1380 -4.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7670 6.3390 -4.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3380 7.4850 -6.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1040 6.2150 -6.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6160 6.0360 -8.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0130 7.1600 -8.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2810 5.5200 -9.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9280 3.7550 -6.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5230 3.9950 -7.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1560 3.6160 -7.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 1.5790 1.6280 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.6260 1.2130 1.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9160 5.5980 -7.2170 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.9250 5.7040 -7.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 51 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 2 51 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 51 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 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 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 17 2 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 13 2 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 19 53 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 20 53 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 21 53 1 0 0 0 0 51 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 51 1 M CHG 1 53 1 M END