PUBCHEM-ZINC03870134 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 1 0 0 0 0 0999 V2000 0.0670 1.7450 -0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 0.4730 0.1500 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4000 0.0740 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1820 1.1480 -0.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2930 2.1750 -0.6210 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5940 3.4460 -1.2510 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3180 3.2270 -2.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1240 4.5760 -0.3740 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8840 5.1280 -0.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9200 5.4640 -0.1620 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2480 6.4890 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 5.2760 -1.4460 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4830 5.9660 -2.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4150 3.9370 -1.9230 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4140 5.3790 -1.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9310 6.6950 -1.2730 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4430 7.6980 -0.0720 P 0 0 0 0 0 0 0 0 0 0 0 0 -0.1560 8.2860 -0.6310 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2390 5.0130 1.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4540 5.7730 1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6940 4.1850 0.8660 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9330 4.2320 1.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5080 1.2640 -0.6170 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8460 -1.3040 0.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0320 -1.6260 0.1660 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7990 -2.1900 0.3680 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9770 -3.6540 0.3970 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8240 -3.8630 1.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2960 -4.3820 0.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4530 -4.7040 2.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4340 -4.2610 3.1230 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3210 -4.2430 -1.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7090 -3.7270 -1.9960 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 2.3870 -0.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8540 4.9260 -2.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8070 4.7840 -0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0980 0.4380 -0.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9880 2.1270 -0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1320 -1.7870 0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1850 -3.8130 0.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3690 -5.3560 0.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5870 8.6840 0.0910 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.2160 6.7500 1.1120 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.4840 -5.3880 2.6230 O 0 5 0 0 0 0 0 0 0 0 0 0 2.1640 -5.1900 -1.0120 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 14 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 21 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 19 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 39 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 32 1 0 0 0 0 29 30 1 0 0 0 0 29 40 1 0 0 0 0 29 41 1 0 0 0 0 30 31 2 0 0 0 0 30 44 1 0 0 0 0 32 33 2 0 0 0 0 32 45 1 0 0 0 0 M CHG 1 42 -1 M CHG 1 43 -1 M CHG 1 44 -1 M CHG 1 45 -1 M END