PUBCHEM-ZINC05923145 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 40 0 0 1 0 0 0 0 0999 V2000 5.4400 -0.0300 -4.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0400 0.3690 -4.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9270 -0.2270 -3.8230 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0330 -1.3220 -3.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9240 0.1700 -2.3200 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8940 -0.1020 -1.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6420 1.6760 -2.0060 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7970 2.0150 -2.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2780 2.0050 -0.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8300 1.6570 -0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2470 1.3910 0.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7950 2.5060 -2.3830 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6590 3.7950 -2.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6410 4.4500 -2.9750 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9360 4.4190 -3.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5610 5.1760 -2.3570 N 0 3 0 0 0 0 0 0 0 0 0 0 5.1410 5.3550 -1.1690 O 0 5 0 0 0 0 0 0 0 0 0 0 6.6930 5.7390 -2.7150 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4690 7.1180 -2.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9710 -0.6760 -1.6570 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 -0.6520 -2.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5040 0.0320 -4.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5870 -0.3460 -3.5720 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6870 0.3660 -3.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5440 -1.1190 -4.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1810 0.3590 -4.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9600 1.4590 -4.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9120 0.0150 -5.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3540 3.0950 -0.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6640 0.5810 -0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 2.1050 0.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1350 2.0500 -0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2830 1.6620 0.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0260 1.7590 1.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1760 0.3000 0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7210 2.1080 -2.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3300 4.2420 -4.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7090 7.2470 -3.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1740 7.6520 -2.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4070 7.5490 -3.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4130 0.5660 -5.5080 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 22 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 20 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 29 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 15 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 18 1 0 0 0 0 18 19 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 M CHG 1 16 1 M CHG 1 17 -1 M CHG 1 41 -1 M END