PUBCHEM-ZINC01187319 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 0 0 0 0 0 0 0 0999 V2000 0.0430 1.4730 -0.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 0.0710 -0.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 -0.6040 -0.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 0.0630 -0.6190 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6640 -0.3660 -0.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4560 0.7420 -0.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6760 1.8220 -0.5760 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 1.4310 -0.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 2.1500 -0.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9300 0.7530 -0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6360 -0.4480 -0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0060 -0.4360 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6830 0.7640 0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9870 1.9660 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6110 1.9620 -0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6750 3.1780 0.1540 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0880 4.2330 0.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0000 4.1050 1.2790 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7670 5.5470 0.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0130 5.6980 0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6440 6.9290 0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0450 8.0150 0.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8080 7.8830 1.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1550 6.6540 1.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8300 6.5090 2.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7510 6.1990 3.1970 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1750 9.0510 2.0510 N 0 3 0 0 0 0 0 0 0 0 0 0 8.7440 10.1280 2.0570 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0850 8.9360 2.5830 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.8820 2.0100 -1.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 -0.4690 -0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 -1.6810 -0.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9900 -1.3900 -0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 3.2280 -0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1100 -1.3880 -0.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5510 -1.3670 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7550 0.7680 0.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0690 2.8950 -0.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5750 3.2600 -0.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4860 4.8550 -0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6100 7.0420 -0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5460 8.9710 0.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7100 6.7220 1.3080 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8660 6.6160 1.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 9 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 32 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 34 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 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 37 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 43 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 43 44 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M END