PUBCHEM-ZINC04774279 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 -0.6210 1.5060 -0.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6010 0.0480 -0.1420 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5050 -0.5860 1.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4320 0.0500 2.1620 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4980 -1.9730 1.0960 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4000 -2.7800 2.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4870 -4.0120 2.0870 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4430 -3.7160 1.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -4.8010 3.3730 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7150 -4.1740 4.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4590 -5.8200 3.3750 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3470 -5.2590 3.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 -6.0610 1.8510 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7510 -6.1020 1.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 -4.8920 1.1480 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0930 -7.2360 1.2230 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 -7.4100 0.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 -8.5850 0.2890 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1980 -9.2020 0.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7650 -8.3820 0.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0690 -8.6680 1.0370 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3550 -9.9020 0.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5270 -10.8020 0.0060 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2230 -10.4630 -0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6340 -11.3660 -0.7350 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 -6.8970 4.0450 O 0 5 0 0 0 0 0 0 0 0 0 0 1.9310 -5.5190 3.3290 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6300 -6.3720 3.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6680 -0.6040 -1.1670 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7540 -0.0920 -2.2900 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2330 1.8560 -0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5560 1.8380 -0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 1.9610 0.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 -2.4860 0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -2.1640 3.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4260 -3.0710 2.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9660 -6.6470 1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3900 -10.2120 0.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6090 -11.1260 -0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2590 -12.2520 -1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 15 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 27 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 26 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 27 28 1 0 0 0 0 29 30 2 0 0 0 0 M CHG 1 26 -1 M END