PUBCHEM-ZINC04904969 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 1 0 0 0 0 0999 V2000 -1.0220 1.8030 1.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4230 0.5190 0.8620 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3270 0.7570 0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2050 -0.2900 1.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7050 -1.6030 1.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8720 -1.9540 1.6100 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3370 -2.4630 0.7730 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1050 -2.7020 1.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9360 -1.6420 -0.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2820 0.4020 -0.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6460 0.7920 -0.3230 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5770 1.7680 0.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7420 0.8290 -1.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4580 -0.3260 -1.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4460 -0.2800 -2.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7270 0.9170 -3.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0110 2.0680 -3.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0240 2.0320 -2.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2830 3.3260 -3.7190 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.0490 3.2890 -4.6900 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7230 4.3480 -3.2990 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.9200 -0.1570 0.7300 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2510 -3.7660 0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2710 2.3520 2.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3640 2.4770 0.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8660 1.5930 2.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0470 0.2570 2.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5130 -0.4980 2.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1980 -1.3910 -1.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7730 -2.1830 -0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4110 -0.3020 -1.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7050 1.2550 -1.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2510 -1.2790 -1.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9960 -1.1820 -2.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4980 0.9300 -4.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4670 2.9330 -1.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8570 -0.0340 0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -4.3570 1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5210 -4.3740 -0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0470 -3.5810 -0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4850 -0.3280 0.1690 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.2530 -0.5550 0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 41 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 23 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 22 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 41 42 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M CHG 1 41 1 M END