PUBCHEM-ZINC03752744 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 0 0 0 0 0 0999 V2000 0.0120 1.7730 -0.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 0.3590 -0.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2020 -0.2760 -0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4350 0.3420 -0.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6130 -0.4180 -0.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5810 -1.8050 -0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3450 -2.4250 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1760 -1.6620 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -2.2850 0.2390 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.8260 -2.5750 -0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2320 -3.7250 -0.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5680 -4.0240 -0.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5000 -5.0360 -0.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7430 -5.0480 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0850 -4.0500 0.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1800 -3.0360 1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9320 -3.0560 0.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8630 -2.2060 0.6910 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8390 -1.4140 1.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7100 -5.9930 -0.3100 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.3180 -7.3120 -0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4740 -7.8930 0.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1410 -9.2440 0.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6650 -10.0160 -0.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5280 -9.4410 -1.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8610 -8.0900 -1.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4670 -4.5050 -1.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0590 -5.8760 -1.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0400 -5.8830 -0.5420 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0480 2.1170 -0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 2.0640 -1.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5580 2.2560 0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5210 1.4100 -0.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5600 0.0880 -0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2780 -3.4980 0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2390 -5.7990 -1.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0640 -4.0640 1.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4390 -2.2640 1.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0650 -7.3040 1.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4680 -9.6920 1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3970 -11.0660 -0.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9350 -10.0440 -2.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5330 -7.6420 -2.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0870 -4.6310 -2.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5700 -3.9670 -2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7660 -6.8470 -1.6910 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 25 2 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 28 29 2 0 0 0 0 28 46 1 0 0 0 0 M CHG 1 46 -1 M END