PUBCHEM-ZINC03870358 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 39 0 0 1 0 0 0 0 0999 V2000 0.0810 1.3410 0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3520 0.0940 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6540 -0.3500 -0.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6300 0.6050 -1.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2710 1.6460 -0.2340 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7990 2.5020 -0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7940 0.4990 -1.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6240 1.3950 -1.9750 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8950 -0.7120 -2.5510 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9230 -1.5630 -2.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7690 -1.4720 -1.6790 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 -2.2180 -1.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6280 -0.5980 0.2770 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7950 -1.4230 -0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7690 -1.1240 1.7180 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1470 -2.0080 1.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2710 -1.4340 1.7840 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6370 -1.4750 2.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9160 -0.2550 1.0170 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1420 0.5720 1.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1440 -0.6190 0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6220 0.5300 -0.5060 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1160 0.7120 -2.0630 P 0 0 0 0 0 0 0 0 0 0 0 0 -3.5950 0.5710 -1.9090 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4970 -2.7030 1.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3890 -3.0130 1.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4700 -0.1390 2.7120 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 -0.0260 2.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3690 2.0550 1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9810 -2.5190 -2.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9300 -1.4270 -0.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9470 -0.9670 0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8130 0.2730 0.1450 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.6220 1.2580 0.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1260 0.3520 -0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7660 -0.4460 -2.7940 O 0 5 0 0 0 0 0 0 0 0 0 0 -5.5870 2.1020 -2.4370 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 29 1 0 0 0 0 2 3 1 0 0 0 0 2 13 1 0 0 0 0 3 4 2 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 33 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 27 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 25 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 33 1 0 0 0 0 21 22 1 0 0 0 0 21 31 1 0 0 0 0 21 32 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 25 26 1 0 0 0 0 27 28 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 M CHG 1 33 1 M CHG 1 36 -1 M CHG 1 37 -1 M END