PUBCHEM-ZINC04096538 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 -0.1850 1.3130 0.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 -0.1770 0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4280 -1.0220 1.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4200 -2.4150 1.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1650 -2.9410 -0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 -2.1330 -1.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0920 -0.7350 -1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3820 0.1420 -2.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 -4.3050 -0.0700 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5150 -4.5310 1.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6350 -3.4090 1.9300 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0710 -5.3230 -1.1010 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5460 -4.9330 -2.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3980 -5.7680 -1.3170 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8850 -5.7970 -0.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 -7.2300 -1.7460 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0580 -7.8660 -1.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0450 -7.6780 -0.9540 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6700 -8.3740 -1.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8400 -6.4890 -0.7270 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3410 -8.3010 0.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 -8.9060 0.9860 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5150 -9.9720 2.2070 P 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 -9.1650 3.2210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8850 -7.2360 -3.1550 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3330 -6.3840 -3.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9550 -5.1120 -2.3360 O 0 5 0 0 0 0 0 0 0 0 0 0 0.7980 1.7370 0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9420 1.7840 -0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4220 1.5700 1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6280 -0.6210 2.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3180 -2.5810 -2.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 0.7460 -2.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5630 -0.4500 -3.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4690 0.8000 -2.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6250 -5.5280 1.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1130 -9.0610 0.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7190 -7.5420 1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9060 -10.3770 2.6790 O 0 5 0 0 0 0 0 0 0 0 0 0 0.2700 -11.0930 1.5360 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 31 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 2 0 0 0 0 10 36 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 20 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 27 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 25 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 25 26 1 0 0 0 0 M CHG 1 27 -1 M CHG 1 39 -1 M CHG 1 40 -1 M END