PUBCHEM-ZINC04716820 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 58 0 0 1 0 0 0 0 0999 V2000 1.0170 2.6640 -0.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2760 1.4350 -0.2480 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7950 1.6380 -0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 1.1170 1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0650 -0.0330 1.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4150 -0.3460 3.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1480 0.2980 4.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2920 0.0100 5.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2950 -0.9220 5.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8580 -1.5660 4.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4140 -1.2820 3.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5380 0.2910 -1.1240 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2080 0.1030 -2.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0970 0.8820 -2.5000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -1.0740 -3.1310 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0890 -1.0100 -3.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 -2.3740 -2.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8320 -3.5060 -3.5640 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.7430 -2.1600 -4.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8390 -1.0070 -4.2710 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8470 0.0350 -5.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1450 1.0010 -4.9110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7270 0.0000 -6.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1980 1.4180 -6.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0920 1.3820 -7.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3010 0.8200 -9.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8300 -0.5980 -8.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9360 -0.5630 -7.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0880 2.4610 -0.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 2.8910 -1.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8220 3.5160 -0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8130 0.8280 1.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6490 1.9990 1.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1150 0.2560 1.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 -0.9150 1.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9310 1.0260 4.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1470 0.5140 6.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6400 -1.1460 6.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6410 -2.2940 4.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8510 -1.7880 2.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 -0.3320 -0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8720 -2.7430 -1.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7740 -2.2270 -1.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8830 -2.4020 -5.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7000 -1.9670 -3.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5920 -0.6340 -6.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7620 1.8190 -5.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3330 2.0520 -6.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9570 0.7480 -7.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4270 2.3930 -8.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9380 0.7940 -9.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4360 1.4540 -9.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6950 -1.2320 -8.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2660 -0.9990 -9.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0710 0.0720 -7.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 -1.5730 -7.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 12 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 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 20 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 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 28 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 M END