PUBCHEM-ZINC04395156 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 52 0 0 0 0 0 0 0 0999 V2000 -0.6660 1.4820 -0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 0.0530 0.0840 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1640 -0.2140 1.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0670 -1.0630 -1.0900 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.4310 -2.3810 -0.6130 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4770 -0.6110 -2.4010 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6540 -0.9460 -1.0080 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3530 -2.1770 -1.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8520 -2.1170 -1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7450 0.3810 -1.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2500 0.2840 -1.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9840 -0.7870 -1.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6620 0.0560 -2.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0510 0.3480 -3.6370 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9620 0.4240 -2.3300 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7580 1.2250 -3.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2470 0.8950 -3.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1110 1.7640 -4.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8480 3.2500 -3.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3670 3.5870 -3.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4980 2.7200 -3.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1950 2.0450 0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7630 1.6520 -1.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5700 1.8800 0.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7940 0.3720 2.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3110 -1.2670 1.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8820 0.0580 1.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9430 -3.0670 -1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2000 -2.2690 -2.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0290 -2.0920 -0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3730 -2.9750 -1.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1970 1.2440 -1.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9040 0.4520 -0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1120 0.2550 -2.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7630 1.1800 -1.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3810 -1.8050 -1.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1520 -0.3820 -0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3980 0.1520 -1.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4430 0.9680 -4.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5600 1.0400 -2.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4200 -0.1630 -3.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1700 1.5460 -3.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9050 1.5110 -5.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1890 3.5320 -2.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4320 3.8400 -4.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2050 4.6450 -3.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0600 3.4420 -4.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4410 2.9520 -3.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6980 2.9770 -1.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4750 -0.8640 -1.7700 N 0 3 0 0 0 0 0 0 0 0 0 0 4.3780 -0.8860 -2.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 6 2 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 9 50 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 10 50 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 12 50 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 38 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 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 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 50 1 M END