PUBCHEM-ZINC05442728 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 1 0 0 0 0 0999 V2000 0.8300 0.9160 0.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 -0.4330 0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 -1.1410 1.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 -0.3060 -0.1230 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2110 0.0500 -1.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8090 1.1190 -2.0780 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6830 -1.0080 -2.4040 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0790 -1.9480 -1.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6510 -3.2510 -2.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3730 -4.1400 -1.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8510 -5.3090 -1.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -5.5740 -3.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8770 -4.6190 -3.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4060 -3.4800 -3.3520 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1420 -6.8010 -3.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2320 -7.2600 -4.8660 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7140 -8.4280 -5.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7050 -3.9450 0.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8090 -4.4260 0.6260 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.2610 0.6340 0.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8480 0.7660 1.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9190 1.4490 -0.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3110 1.5660 1.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7410 -1.0420 -0.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5070 -0.5980 2.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2910 -2.1600 1.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 -1.2210 2.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2000 -2.2530 0.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4350 -6.0180 -1.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6510 -4.7420 -4.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2840 -7.5980 -3.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1080 -6.5600 -4.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9820 -8.7300 -6.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8320 -9.2450 -4.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6660 -8.2240 -6.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8890 1.6630 0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2330 0.6590 0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4480 0.3190 1.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9000 -1.6070 -0.2660 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8580 -3.3310 0.9520 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 24 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 1 0 0 0 0 4 20 1 0 0 0 0 4 39 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 40 2 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 28 39 1 0 0 0 0 M CHG 1 19 -1 M END