PUBCHEM-ZINC03651598 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 39 0 0 1 0 0 0 0 0999 V2000 -0.5380 1.4470 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2460 -0.0310 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1270 -0.7000 1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3940 -2.0560 1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 -2.7450 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 -2.0800 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 -0.7210 -1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7310 -0.0650 -2.2890 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8260 -0.8400 -3.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 0.0630 -4.6450 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5660 0.9040 -4.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2360 -0.7370 -5.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5210 -0.5780 -8.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0880 -0.6640 -8.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3970 0.1530 -9.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5760 0.5510 -4.4050 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2410 0.0340 2.4690 N 0 3 0 0 0 0 0 0 0 0 0 0 0.6740 1.1730 2.4810 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0980 -0.5000 3.5100 O 0 5 0 0 0 0 0 0 0 0 0 0 0.3940 2.0050 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2040 1.7140 -0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0140 1.6920 1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6860 -2.5780 2.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5000 -3.8040 -0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1650 -2.6190 -2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 -1.2820 -3.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5630 -1.6310 -3.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2510 -1.1830 -6.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9880 -1.5250 -5.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9100 -1.5840 -8.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 -1.2100 -9.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3020 0.3420 -9.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5360 -1.1850 -8.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3900 -0.3930 -10.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4180 0.2140 -8.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0080 1.1590 -9.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2430 -0.1450 -4.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5310 0.1570 -7.0770 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4100 0.6320 -6.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 17 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 5 6 2 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 30 1 0 0 0 0 13 38 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 38 39 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M END