PUBCHEM-ZINC02009221 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 45 0 0 0 0 0 0 0 0999 V2000 0.7470 -2.0280 -0.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -1.9880 0.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 -0.4510 2.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1490 -0.6120 2.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2600 -0.2360 1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 1.2830 1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7850 1.6720 0.9760 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1420 2.9710 1.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3080 3.8190 1.2910 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5430 3.3640 0.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4990 2.3940 0.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8200 2.7730 0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1820 4.1240 0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2370 5.0820 0.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9160 4.7160 0.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6280 6.5080 0.6850 N 0 3 0 0 0 0 0 0 0 0 0 0 8.7840 6.8320 0.4820 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7930 7.3580 0.9410 O 0 5 0 0 0 0 0 0 0 0 0 0 8.8370 1.7510 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5240 0.5790 -0.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1150 2.1180 -0.2660 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0620 1.0590 -0.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7380 -1.6860 -1.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5950 -3.0490 -1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -1.3770 -1.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3690 -2.3200 1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3750 -2.6480 1.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6420 0.5410 2.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8330 -1.2080 3.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5010 -0.4900 3.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6110 0.1450 1.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4200 -1.6040 2.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6410 -0.5540 0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8340 -0.7190 1.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7480 1.7670 0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1010 1.5910 2.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4500 0.9960 0.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2180 1.3530 0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2060 4.4160 0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0500 1.4900 -0.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0990 0.3580 0.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7460 0.5340 -1.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 -0.6150 1.2110 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9880 5.6630 1.1250 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8930 5.8540 2.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 2 43 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 43 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 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 5 34 1 0 0 0 0 5 43 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 13 14 2 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 44 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END