PUBCHEM-ZINC00591620 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 61 0 0 1 0 0 0 0 0999 V2000 -1.5900 0.6630 -0.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 -0.6840 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -1.1370 -0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 -0.2200 -0.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7440 1.1350 -0.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5690 1.5820 -0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9760 1.8460 -0.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1860 3.1700 -1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4920 3.5960 -1.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5650 2.6890 -1.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3620 1.3490 -1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0610 0.9450 -0.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5500 -0.4420 -0.3630 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7910 -1.1320 -1.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1880 -2.4930 1.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0560 -2.9460 2.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6470 -2.3030 3.4280 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5710 -0.8340 3.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7240 -0.3380 2.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3630 -3.1060 4.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2740 -4.3290 4.4850 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1480 -2.4660 5.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9130 -2.6260 6.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6770 -2.0540 7.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7240 -1.3370 8.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9760 -1.1850 7.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1990 -1.7680 6.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7790 -0.4220 8.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0140 -0.1260 9.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7760 -0.6820 9.5320 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0090 -0.6240 10.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9230 3.1510 -1.7170 N 0 3 0 0 0 0 0 0 0 0 0 0 6.0450 4.2260 -2.3190 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8640 2.4300 -1.3520 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.6270 0.9920 -0.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1060 -1.3840 0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -2.1870 0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8150 2.6170 -0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3600 3.8710 -1.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6550 4.6350 -1.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1890 0.6450 -0.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5790 -2.8910 0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1490 -2.8000 1.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0190 -4.0360 2.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1030 -2.6690 2.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1450 -0.4300 4.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5990 -0.4620 3.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6760 -0.6260 2.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8070 0.7480 2.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 -3.2040 5.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7190 -2.1730 8.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1700 -1.6820 5.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8080 -0.1230 8.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2430 0.4270 10.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2120 -0.9730 0.9030 N 0 3 0 0 0 0 0 0 0 0 0 0 4.2020 -0.7150 0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 35 1 0 0 0 0 2 3 2 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 4 5 2 0 0 0 0 4 13 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 55 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 15 55 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 19 55 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 25 26 2 0 0 0 0 25 30 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 52 1 0 0 0 0 28 29 2 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 30 31 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 55 56 1 0 0 0 0 M CHG 1 32 1 M CHG 1 34 -1 M CHG 1 55 1 M END