PUBCHEM-ZINC06361313 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 55 0 0 1 0 0 0 0 0999 V2000 -0.1980 1.7300 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3750 0.2490 -0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8370 -0.3470 0.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9650 -1.5510 0.5750 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8590 0.7090 0.7760 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7760 0.8680 1.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3200 1.9390 0.0090 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6760 1.9010 -1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7280 3.2660 0.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 4.5260 -0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 4.3710 -1.3630 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2870 0.3480 0.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9360 -0.6500 1.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4220 -1.8330 0.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0930 -2.8260 1.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3660 -4.1710 1.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1160 -5.0830 2.6020 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4820 -6.3650 2.6890 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4420 -6.2400 3.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2750 -7.1800 3.7260 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3060 -6.6830 4.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6820 -8.5860 3.8270 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6570 -8.5330 4.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6930 -9.2530 2.4440 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2330 -10.2460 2.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9540 -8.3530 1.4440 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8970 -8.2540 1.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5160 -7.0240 1.4180 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0400 -8.8900 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2950 -8.0260 -0.8460 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6180 -7.1260 -0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0550 -9.4520 2.0290 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5260 -8.6040 2.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4450 -9.3680 4.7450 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3390 -9.4280 4.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6500 -7.2990 3.2780 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9170 -6.3820 3.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 2.3490 -0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6200 1.9690 0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2980 -0.1440 0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3290 0.0450 -1.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3060 3.3350 1.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8190 3.3030 0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2910 -0.0270 -0.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9140 1.2480 0.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0210 -0.3630 2.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3420 -2.1070 -0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1250 -2.9770 1.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1760 -2.4450 2.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3600 -4.0500 2.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2800 -4.5670 0.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0700 -8.9030 -0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 -9.8970 -0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 5.5780 0.5700 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 7 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 40 1 0 0 0 0 2 41 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 12 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 9 43 1 0 0 0 0 10 11 2 0 0 0 0 10 54 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 14 2 0 0 0 0 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 16 17 1 0 0 0 0 16 50 1 0 0 0 0 16 51 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 28 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 36 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 34 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 32 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 29 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 30 31 1 0 0 0 0 32 33 1 0 0 0 0 34 35 1 0 0 0 0 36 37 1 0 0 0 0 M CHG 1 54 -1 M END