PUBCHEM-ZINC06437689 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 32 0 0 1 0 0 0 0 0999 V2000 0.0280 1.5660 -0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 0.1270 -0.0510 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -0.5990 1.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -0.1330 2.2480 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -2.1160 0.7470 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2590 -2.9320 1.1640 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1270 -3.9280 0.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1910 -3.1770 2.6870 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2910 -2.2520 3.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1120 -3.8840 3.0520 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1240 -4.8810 2.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2920 -3.0500 2.5550 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3560 -2.0960 3.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 -2.7800 1.1440 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6160 -3.7870 2.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6820 -3.0080 2.2250 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3410 -2.6850 1.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 -4.0720 4.4660 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7430 -4.3510 4.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2930 -4.0120 3.0710 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9900 -3.6680 2.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4050 -2.3010 0.9220 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0950 -2.0020 -0.6900 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1390 -2.7960 -1.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 -0.7020 -1.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1900 -0.3730 -2.3090 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0610 1.9090 -0.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5390 1.8900 -1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4010 1.9960 0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8210 -3.9570 3.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6220 -4.7500 2.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 25 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 14 1 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 22 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 20 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 M CHG 1 22 -1 M END