PUBCHEM-ZINC05834005 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 0.3370 1.6890 -0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2380 0.1770 0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 -0.2680 1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2140 -0.1900 0.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9260 -0.4300 -1.8020 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5520 0.2100 -1.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7870 0.1020 -3.2380 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1160 -0.5940 -3.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2030 -0.2110 -3.7860 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1520 -0.4880 -4.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6600 -1.4080 -3.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6220 -1.7540 -2.1250 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9500 -2.4530 -2.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1620 -2.4600 -0.9900 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4470 -2.4890 -0.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5720 -3.2750 0.5210 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3060 -3.7750 0.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4110 -3.2610 -0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0870 -3.4830 -0.2490 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -4.3580 0.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4620 -4.9450 1.6680 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7900 -4.6640 1.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5690 -5.2560 2.6840 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2980 0.8510 -3.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5290 0.3550 -4.1430 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5720 -0.5810 -3.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4830 1.3810 -3.2360 O 0 5 0 0 0 0 0 0 0 0 0 0 1.3630 2.0070 -0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3040 2.0160 -0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 2.2330 0.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9310 0.2820 2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0390 -1.3290 1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2170 -0.0850 1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9040 0.1060 -0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3280 -1.2700 0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5370 0.3110 1.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2510 -1.9330 -0.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3470 -4.6220 0.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5570 -5.0430 2.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1340 -5.8880 3.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0610 1.7820 -4.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4770 1.0640 -2.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 -0.5700 -1.1800 N 0 3 0 0 0 0 0 0 0 0 0 0 0.3270 -1.5700 -1.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0670 -0.1880 -1.9060 H 0 0 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 4 1 0 0 0 0 2 43 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 12 1 0 0 0 0 5 43 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 27 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 24 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 43 44 1 0 0 0 0 43 45 1 0 0 0 0 M CHG 1 27 -1 M CHG 1 43 1 M END