PUBCHEM-ZINC06863098 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 -1.9660 1.4670 -0.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1430 0.0970 -0.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0660 -0.6400 -1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8360 0.0220 -2.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6530 1.3950 -2.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7170 2.1210 -1.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4510 2.0790 -3.4260 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.2950 1.4120 -4.0400 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2330 3.2840 -3.6170 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.2920 -2.0720 -0.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3070 -2.9510 -0.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6300 -4.3890 -0.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7870 -4.7890 -0.6110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4920 -5.1510 -0.3790 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4340 -6.5460 -0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 -7.1170 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -8.4940 0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1120 -9.2670 0.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3730 -8.7120 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5680 -7.3630 -0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3460 -9.7860 0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5490 -9.6170 0.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6260 -10.9420 0.3110 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2780 -10.7030 0.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3500 -11.4770 0.5390 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2360 -12.2600 0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4680 -12.8040 -1.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2040 -14.1360 -1.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4390 -14.6440 0.1130 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 2.0230 -0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5560 -0.3810 0.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5660 -0.5410 -2.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5640 3.1860 -1.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3270 -2.4040 -1.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2680 -2.6460 -0.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5990 -4.6740 -0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -6.4880 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0090 -8.9330 0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5780 -6.9900 -0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5760 -12.9250 0.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1870 -12.1680 0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0560 -12.0920 -1.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5090 -12.9370 -1.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4880 -14.5770 -2.1670 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 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 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 10 11 2 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 24 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 26 1 0 0 0 0 24 25 2 0 0 0 0 26 27 1 0 0 0 0 26 40 1 0 0 0 0 26 41 1 0 0 0 0 27 28 1 0 0 0 0 27 42 1 0 0 0 0 27 43 1 0 0 0 0 28 29 2 0 0 0 0 28 44 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M CHG 1 44 -1 M END