PUBCHEM-ZINC03873241 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -1.3570 0.9000 1.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9770 1.1540 0.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2520 3.0300 1.5050 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6600 3.3460 0.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2080 3.4410 2.6240 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1570 2.9240 2.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4500 4.9500 2.5760 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8230 5.2290 1.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4830 5.3250 3.6360 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3880 4.7360 3.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8220 6.7960 3.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4590 7.5450 2.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5740 7.3690 4.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2110 8.5990 4.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9150 9.1140 5.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9940 8.4170 6.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3660 7.1880 7.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6430 6.6550 5.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9520 5.3640 6.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8980 5.0290 5.0270 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5360 3.5650 5.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9510 2.8430 5.9500 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6210 3.0510 3.9810 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7390 3.6780 4.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 3.9350 5.2590 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5400 3.9710 3.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8020 4.5580 3.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 4.7040 4.4530 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5100 4.9750 2.1430 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0900 3.6810 1.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7860 3.9570 0.7630 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.6280 4.0750 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2200 4.5910 6.9520 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4500 6.5080 8.1760 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1250 9.4870 3.1080 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.2260 5.6400 2.8360 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2290 -0.1790 1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6510 1.1570 0.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1320 1.2260 1.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6690 1.3450 -0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 0.0890 0.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8840 1.7180 0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0620 7.0800 1.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5620 8.6190 2.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4080 10.0700 5.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5510 8.8330 7.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1060 4.0440 5.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8640 5.4680 4.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3740 5.3730 2.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0940 1.3140 4.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0160 5.6470 5.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2040 5.9050 8.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3060 6.6030 2.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 1.5700 1.5110 N 0 0 0 0 0 0 0 0 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 54 1 0 0 0 0 2 40 1 0 0 0 0 2 41 1 0 0 0 0 2 42 1 0 0 0 0 2 54 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 30 1 0 0 0 0 3 54 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 23 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 36 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 20 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 12 43 1 0 0 0 0 12 44 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 35 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 16 17 2 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 33 2 0 0 0 0 20 21 1 0 0 0 0 20 51 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 32 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 30 31 2 0 0 0 0 32 50 1 0 0 0 0 34 52 1 0 0 0 0 36 53 1 0 0 0 0 M END