PUBCHEM-ZINC04517884 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 43 0 0 0 0 0 0 0 0999 V2000 -0.0260 1.3650 0.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 -0.0300 0.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9780 -0.7600 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1310 -0.1190 -0.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2080 1.2750 -0.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1360 2.0410 0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2050 3.5100 0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2130 4.2370 0.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 5.5960 0.7500 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 6.2200 0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1790 7.6090 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1470 8.3040 -0.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8650 7.5590 -1.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 6.1650 -1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 5.4860 -0.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1830 4.1420 -0.4950 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 9.8140 -0.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 10.4150 -0.0650 O 0 5 0 0 0 0 0 0 0 0 0 0 3.3190 3.6480 1.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6510 3.9950 1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7120 3.4310 1.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4520 2.5200 2.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1460 2.1730 3.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0860 2.7420 2.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5170 1.9840 3.6590 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1910 1.3780 4.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9510 -2.1230 -0.0840 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 -2.4330 0.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8790 1.9370 0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0160 -0.5190 0.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9680 -0.7000 -0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1150 1.7580 -0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9770 8.1720 0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6800 8.0670 -1.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6300 5.6000 -1.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8670 4.7140 0.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7360 3.7050 1.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9300 1.4710 4.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0690 2.4720 2.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 10.3670 -1.2120 O 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 27 1 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 16 2 0 0 0 0 8 9 2 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 17 18 1 0 0 0 0 17 40 2 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 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 24 39 1 0 0 0 0 25 26 1 0 0 0 0 27 28 1 0 0 0 0 M CHG 1 18 -1 M END