PUBCHEM-ZINC02529449 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 -0.0320 1.4210 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -0.0080 0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6220 -0.6240 1.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 0.1270 2.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8440 -0.5010 3.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9080 -1.8830 3.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3330 -2.6440 2.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6800 -2.0210 1.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -2.8340 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1090 -4.2300 0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4900 -4.9420 -0.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 -4.2840 -1.9230 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.1220 -2.9660 -1.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5710 -2.2460 -0.9830 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7260 -5.0320 -3.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1630 -5.3120 -2.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6120 -4.9240 -1.5950 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9500 -5.9930 -3.5090 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2550 -6.3370 -3.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0020 -5.4770 -2.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2890 -5.8190 -1.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8350 -7.0160 -2.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0940 -7.8740 -3.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8080 -7.5350 -3.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6920 -9.1780 -3.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9950 -9.2950 -3.1620 F 0 0 0 0 0 0 0 0 0 0 0 0 -7.7210 -9.2090 -5.0560 F 0 0 0 0 0 0 0 0 0 0 0 0 -6.9160 -10.2410 -3.1840 F 0 0 0 0 0 0 0 0 0 0 0 0 0.9890 1.8020 0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 1.7850 -0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.7660 0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1580 1.2060 2.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2960 0.0880 3.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4100 -2.3670 3.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3860 -3.7220 2.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -4.7400 0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4690 -6.0220 -0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6200 -2.4630 -2.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6870 -4.4450 -3.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1990 -5.9750 -3.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6120 -6.2450 -4.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5760 -4.5420 -2.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8700 -5.1510 -1.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8420 -7.2820 -2.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2320 -8.2040 -4.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 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 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 34 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 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 M CHG 1 12 1 M END