PUBCHEM-ZINC06591504 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 1 0 0 0 0 0999 V2000 -1.6060 0.2830 -1.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 -0.6330 -0.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 0.1910 0.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9100 -0.6960 1.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7480 -1.7300 0.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8990 -2.5050 -0.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 -1.5900 -1.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9880 -1.1130 0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1450 0.0970 -0.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9090 -2.0560 -0.2950 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1870 -1.7690 -0.9690 C 0 0 3 0 0 0 0 0 0 0 0 0 5.5740 -0.8170 -0.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0510 -1.7730 -2.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5070 -0.4940 -3.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2410 -0.2900 -3.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1430 1.0160 -3.9680 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3160 1.4430 -4.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3340 1.6700 -3.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2120 0.7470 -3.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5200 1.1680 -2.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9000 2.4900 -3.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 3.3880 -3.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6980 2.9960 -4.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2190 -2.8950 -0.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7010 -4.0040 -0.3650 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9460 0.9080 -1.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2390 -0.3030 -1.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2570 0.9450 -0.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -1.2270 0.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6920 0.8790 0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5960 0.8160 1.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5560 -0.0630 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2450 -1.2310 2.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1300 -2.4480 1.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5230 -3.1520 -0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2150 -3.1680 0.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 -2.2060 -1.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -1.0180 -1.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7720 -3.0500 -0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0220 -1.9480 -2.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4080 -2.6070 -2.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 -0.9620 -3.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2260 0.4730 -2.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9070 2.8150 -2.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3140 4.4120 -3.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9980 3.6980 -4.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4320 -2.5730 -0.8400 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 24 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 M CHG 1 47 -1 M END