PUBCHEM-ZINC06657308 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 -0.7640 2.0830 -1.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3400 0.6330 -1.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4760 -0.1040 -0.8760 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3150 -1.4410 -0.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1260 -2.1470 -0.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 -3.5110 -0.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1630 -4.1790 -0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3530 -3.4860 0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4540 -2.1120 -0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7600 -1.3500 0.1040 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6870 -0.3650 -0.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0080 -1.0990 1.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7260 0.0510 2.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1090 -0.0480 3.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6670 -1.2720 3.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7170 -2.2930 2.5930 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.1910 -1.7570 5.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2390 -1.1420 -0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0090 -1.5230 -1.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9270 -1.6100 -2.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7590 -2.2910 -2.1050 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7950 -1.8880 -2.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7820 -3.7980 -2.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0430 -4.5900 -1.4020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 2.6970 -1.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5910 2.1690 -2.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1230 2.4820 -0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 0.2520 -2.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 0.5730 -0.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7660 -1.6670 -1.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8760 -4.0520 -0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1020 -5.2410 0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1970 -4.0450 0.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2660 0.9310 1.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9780 0.7430 4.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2570 -1.9970 5.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6520 -2.6520 5.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0730 -0.9930 6.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9650 -0.0820 -0.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7630 -1.4020 0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4970 -2.4960 -1.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7790 -0.7870 -2.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2740 -2.1440 -3.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6310 -0.6000 -3.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9700 -1.9620 -0.6060 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.1520 -2.8690 -0.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4770 -4.1910 -3.5450 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5070 -5.1720 -3.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 45 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 45 1 0 0 0 0 23 24 2 0 0 0 0 23 47 1 0 0 0 0 45 46 1 0 0 0 0 47 48 1 0 0 0 0 M CHG 1 45 1 M END