PUBCHEM-ZINC05985945 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 -0.3900 1.9460 1.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5650 2.6820 3.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0910 4.3140 2.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9650 4.5410 0.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0080 6.0240 0.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7090 6.2330 -0.6760 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1350 6.5380 -0.7550 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.6490 5.7250 -0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4430 6.4640 -2.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6300 6.4630 -2.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8940 6.5420 -2.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5860 7.7510 -2.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7380 7.7910 -1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2360 6.7250 -0.6060 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.5690 5.5590 -0.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4060 5.4160 -1.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7530 6.3800 -4.2300 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1520 6.3280 -2.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9110 6.3540 -4.1390 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0920 6.1330 -1.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9220 5.8960 -2.1540 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4730 7.8840 -0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7460 9.0460 -0.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0950 10.2790 0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1860 10.3750 0.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9160 9.2350 1.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5600 7.9930 0.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9980 9.3750 2.0950 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4200 0.9300 2.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6420 2.2930 1.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9170 1.9680 0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4800 3.0020 4.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 1.6280 4.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1710 3.2920 4.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 4.5980 2.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4830 4.8910 3.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5790 3.9720 0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9840 4.1790 1.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 6.6140 1.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9830 6.3950 0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2260 8.6500 -2.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3010 8.7120 -1.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0060 4.7150 -0.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9150 4.4500 -1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6960 6.4070 -4.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9000 9.0080 -1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5210 11.1680 -0.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4690 11.3350 1.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1420 7.1110 1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4730 8.5270 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 2.8550 2.5990 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.0910 2.5550 2.6270 H 0 0 0 0 0 0 0 0 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 1 51 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 2 51 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 51 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 22 1 0 0 0 0 9 10 2 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 10 17 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 16 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 2 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 51 52 1 0 0 0 0 M CHG 1 51 1 M END