PUBCHEM-ZINC05588493 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 0 0 0 0 0 0999 V2000 4.0520 0.2980 0.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2050 -0.9380 0.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9270 -0.9700 1.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 -2.1020 0.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -3.2080 0.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9340 -3.1710 -0.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7060 -2.0350 -0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 -4.3550 0.0850 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 -4.9740 -1.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7440 -4.4200 -2.4200 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -6.0280 -1.2750 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 -6.7230 -2.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -8.1150 -2.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 -8.8040 -3.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0630 -8.1040 -4.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0790 -6.7050 -4.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 -6.0230 -3.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 -8.7840 -6.0720 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 -8.1370 -7.1870 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 -8.8170 -8.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1320 -8.1170 -9.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1410 -8.8080 -10.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1240 -10.1970 -10.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0980 -10.8970 -9.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0830 -10.2150 -8.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1330 -10.8740 -11.9520 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1140 -12.3010 -11.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6290 0.2280 1.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 0.3850 -0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4080 1.1770 0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5370 -0.1100 1.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 -2.1270 1.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3280 -4.0290 -0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7040 -2.0050 -0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 -4.7060 0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6170 -6.3040 -0.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -8.6540 -1.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 -9.8840 -3.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0990 -6.1610 -5.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 -4.9440 -3.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 -7.0380 -9.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1620 -8.2680 -11.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 -11.9770 -9.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -10.7600 -7.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1240 -12.7150 -12.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7880 -12.6270 -11.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9920 -12.6490 -11.3360 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 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 M END