PUBCHEM-ZINC04589197 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -4.2750 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3530 -4.7980 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0000 -5.0270 -1.1290 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2300 -5.4830 -1.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5130 -5.6040 0.6740 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.9690 -5.0420 1.1100 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1050 -5.7960 -2.0450 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6900 -5.6290 -3.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4460 -6.2960 -1.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4000 -5.1350 -1.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9980 -4.0020 -1.7730 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6990 -5.3560 -1.3320 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.6400 -4.2340 -1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3580 -4.3350 0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0070 -5.7160 0.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9240 -6.7960 0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2020 -6.7230 -1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7430 -5.8070 1.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7490 -4.8610 2.3340 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.3950 -6.9390 1.9040 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 -4.6260 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -4.6360 0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2300 -6.5510 -3.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5610 -5.3970 -4.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9690 -4.8140 -3.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7800 -6.9600 -2.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4220 -6.8440 -0.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0940 -3.2920 -1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3710 -4.2820 -2.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6390 -4.1960 0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1280 -3.5650 0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7080 -5.8640 -0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2080 -6.6340 1.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3840 -7.7780 0.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8980 -6.9700 -1.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3670 -7.4240 -1.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3900 -7.6960 1.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8690 -6.9980 2.7480 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 7 2 0 0 0 0 3 4 2 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 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 13 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 M END