PUBCHEM-ZINC06024791 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 0.5120 1.9020 0.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 0.4550 0.4390 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0140 -0.0890 0.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4480 -0.3830 0.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7590 0.1140 0.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8810 -0.7270 0.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7400 -2.1160 0.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4450 -2.6310 0.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3300 -1.7800 0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9770 -2.9970 0.4000 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.8550 -2.4050 0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2530 -3.6710 1.7670 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7370 -2.9320 2.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4050 -1.6710 3.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7440 -0.8670 4.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3220 0.3220 4.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5670 0.7160 4.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2300 -0.0790 3.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6540 -1.2710 2.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7760 -3.3330 3.6330 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6760 -5.0440 1.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4180 -5.8990 2.3740 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5760 -5.2990 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3330 -6.3910 -0.4150 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8820 -4.1030 -0.5520 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1450 -3.9850 -1.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4620 -2.8220 -2.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7740 -2.8570 -4.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2240 -1.6050 -4.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0240 -1.6820 -5.2650 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4770 2.4170 0.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 2.2160 -0.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 2.2600 1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1740 -0.6510 1.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2060 -0.7400 -0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7740 0.7000 0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9450 1.1810 0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8650 -0.2720 0.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2650 -3.7010 0.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6450 -2.2520 0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7700 -1.1590 4.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8020 0.9380 5.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0220 1.6390 4.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2030 0.2290 3.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2160 -1.8600 2.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3280 -3.8590 1.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8680 -4.9320 -2.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2320 -3.8880 -2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8050 -1.8690 -2.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3780 -2.8680 -2.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3350 -3.7490 -4.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8570 -2.9090 -4.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0510 -0.6570 -5.0080 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 25 1 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 12 46 1 0 0 0 0 13 14 1 0 0 0 0 13 20 2 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 45 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 29 30 2 0 0 0 0 29 53 1 0 0 0 0 M CHG 1 53 -1 M END