PUBCHEM-ZINC01098136 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -0.0060 0.7540 0.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.6200 0.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4750 -1.1190 0.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5110 -0.3070 0.1630 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3640 1.0090 0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 1.5800 0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4840 1.8270 0.0650 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9930 1.1550 -0.0500 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9060 2.2370 -0.1680 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0760 0.1770 0.9770 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0580 0.2790 -1.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4820 0.9240 -2.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5350 0.2410 -3.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1630 -1.0960 -3.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7370 -1.7410 -2.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6920 -1.0530 -1.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2150 -1.7910 -5.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1680 -1.4950 -6.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0390 -0.6930 -5.8200 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1540 -2.1460 -7.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1540 -3.0680 -7.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1470 -3.6710 -8.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1270 -3.3660 -9.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1210 -2.4540 -9.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1360 -1.8380 -8.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1660 -2.1340 -10.5970 N 0 3 0 0 0 0 0 0 0 0 0 0 8.1510 -2.6730 -11.6890 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0410 -1.3310 -10.3260 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.0010 1.1690 0.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6510 -1.2920 0.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6330 -2.1870 0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 2.6540 0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3810 2.7920 0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7720 1.9640 -2.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8660 0.7450 -4.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4470 -2.7800 -2.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3650 -1.5550 -0.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5650 -2.4860 -5.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3890 -3.3080 -7.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3740 -4.3840 -9.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1170 -3.8410 -10.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9090 -1.1220 -8.1260 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 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 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 42 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 M CHG 1 26 1 M CHG 1 28 -1 M END