PUBCHEM-ZINC02145324 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 6.3300 -0.3350 -3.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5510 -1.4770 -3.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6760 -1.7350 -2.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5790 -0.8460 -1.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3660 0.3050 -1.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2400 0.5560 -2.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2730 1.2060 -0.5390 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4650 -1.1720 -0.2950 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8390 -2.8290 -0.6850 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4720 -2.8460 -1.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6970 -3.1810 0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5640 -2.2840 0.0290 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2160 -2.0360 -1.1120 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -1.7860 0.9680 O 0 5 0 0 0 0 0 0 0 0 0 0 3.9510 -3.8350 -0.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2540 -4.6940 -1.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2740 -5.6170 -1.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9900 -5.6800 -0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6870 -4.8200 0.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6710 -3.8950 0.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1010 -6.6870 -0.0960 C 0 0 3 0 0 0 0 0 0 0 0 0 7.1100 -7.3530 -0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4420 -5.9560 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5320 -6.9340 -0.0050 N 0 3 0 0 0 0 0 0 0 0 0 0 10.5020 -6.7640 -0.7230 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4700 -7.9180 0.7100 O 0 5 0 0 0 0 0 0 0 0 0 0 6.8340 -7.6560 1.4140 S 0 0 0 0 0 0 0 0 0 0 0 0 5.4140 -8.6210 1.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8740 -8.5750 -0.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7600 -9.3340 -0.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1810 -10.1400 0.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7120 -10.1920 1.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8320 -9.4390 1.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3750 -9.4940 3.2780 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0150 -0.1410 -4.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6250 -2.1700 -4.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0680 -2.6270 -2.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8510 1.4470 -2.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6610 1.0300 0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8210 2.0070 -0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3870 -4.2120 0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0370 -3.0680 1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6940 -4.6440 -2.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5100 -6.2880 -2.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2470 -4.8700 1.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4370 -3.2210 1.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5520 -5.2870 -0.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4760 -5.3760 0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3240 -7.9460 -1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3410 -9.2970 -1.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3110 -10.7310 0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2560 -10.8220 2.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1560 -8.9640 3.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9690 -10.0630 3.9510 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 8 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 39 1 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 27 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 25 2 0 0 0 0 24 26 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 49 1 0 0 0 0 30 31 1 0 0 0 0 30 50 1 0 0 0 0 31 32 2 0 0 0 0 31 51 1 0 0 0 0 32 33 1 0 0 0 0 32 52 1 0 0 0 0 33 34 1 0 0 0 0 34 53 1 0 0 0 0 34 54 1 0 0 0 0 M CHG 1 12 1 M CHG 1 14 -1 M CHG 1 24 1 M CHG 1 26 -1 M END