PUBCHEM-ZINC05973334 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 55 0 0 1 0 0 0 0 0999 V2000 1.1330 1.4430 -1.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0320 -0.0710 -1.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3940 -0.5180 -1.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4920 -2.0430 -1.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9220 -2.4890 -0.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0470 -4.0170 -0.7920 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6820 -4.4530 -1.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4650 -4.4380 -0.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1770 -5.2140 -1.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5370 -5.6480 -1.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2500 -6.4680 -1.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6220 -6.7150 -1.3800 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.4070 -6.6350 -2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7650 -5.6270 -0.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3360 -5.2480 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6710 -8.0020 -0.7870 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8570 -7.0920 -3.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3760 -8.5070 -3.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5660 -9.5300 -3.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2820 -9.5060 -5.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3810 -10.0040 -6.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1210 -10.0020 -7.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3220 -10.5000 -8.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1440 -10.8940 -8.7250 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2300 -4.5310 0.2550 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1600 1.7400 -1.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4800 1.8320 -2.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8500 1.9140 -0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3530 -0.5130 -2.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7200 -0.4310 -0.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 -0.0710 -0.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0790 -0.1530 -2.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1760 -2.4890 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1970 -2.4050 -0.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2120 -2.0510 0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6080 -2.0930 -1.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9050 -4.0800 0.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6930 -5.5650 -2.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2620 -4.7500 -0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3430 -5.9430 0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0020 -5.8070 0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2800 -4.1760 0.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5290 -8.0840 -0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7140 -7.0280 -3.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0580 -6.5120 -3.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8030 -8.7110 -2.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1530 -10.4980 -3.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1640 -10.1530 -5.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6450 -8.5030 -5.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4900 -9.3680 -6.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0290 -11.0190 -6.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0170 -10.6300 -7.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4600 -8.9830 -7.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5400 -4.1480 1.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9590 -10.4530 -10.0360 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 25 1 0 0 0 0 8 9 2 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 23 24 2 0 0 0 0 23 55 1 0 0 0 0 25 54 1 0 0 0 0 M CHG 1 55 -1 M END