PUBCHEM-ZINC05160072 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -0.6160 1.0490 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.6720 -1.1690 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -2.1420 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 -2.5940 -2.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1030 -0.4830 -3.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 0.0510 -2.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9490 -2.4840 -4.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5990 -1.9850 -5.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6440 -1.2540 -5.9480 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3480 -2.3510 -6.8510 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0230 -1.8870 -8.1330 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7480 -2.2420 -9.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4200 -1.7720 -10.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0980 -2.0670 -11.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4270 -1.3930 -12.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3900 -0.7280 -12.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3870 -0.9640 -10.7700 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3650 0.1590 -12.8510 N 0 3 0 0 0 0 0 0 0 0 0 0 0.4600 0.3010 -14.0570 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5320 0.7130 -12.2410 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1970 -2.5270 -0.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9340 -2.5130 -1.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1100 -2.3120 -1.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1100 -3.6770 -2.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0300 -0.0380 -4.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0650 -0.2250 -2.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9860 -0.1140 -2.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 1.1160 -2.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9090 -3.5740 -4.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9540 -2.1550 -4.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 -2.9360 -6.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5990 -2.8930 -9.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9720 -2.6920 -11.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6880 -1.4010 -13.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9890 -1.9480 -3.4400 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 5 27 1 0 0 0 0 6 28 1 0 0 0 0 6 29 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 7 40 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 9 40 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END