PUBCHEM-ZINC06344482 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2070 -0.6800 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 0.0300 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4180 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0880 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5860 -0.6320 -0.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7720 0.1640 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9810 -0.7370 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8400 -1.9370 -0.0630 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2140 -0.2060 -0.0670 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3310 -1.1330 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6250 -0.3600 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6050 1.0210 -0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7910 1.7300 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0000 1.0590 -0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0250 -0.3230 -0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8370 -1.0370 -0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8470 -2.3960 -0.0950 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0710 -3.0340 -0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1480 -2.4120 0.2430 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3490 -1.0450 -0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7680 3.2100 -0.0820 N 0 3 0 0 0 0 0 0 0 0 0 0 9.7040 3.8020 -0.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8130 3.8350 -0.0880 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 -1.7600 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3040 1.9720 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 3.1680 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7800 0.7970 -0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7960 0.7880 0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2900 -1.7650 0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2740 -1.7560 -0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6620 1.5470 -0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9260 1.6150 -0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0260 -4.0930 -0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2290 -2.9220 -1.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7710 -0.9950 -1.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0330 -0.5760 0.5650 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 23 1 0 0 0 0 16 17 2 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END