PUBCHEM-ZINC05606636 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 1 0 0 0 0 0999 V2000 0.0040 1.4070 0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -0.0110 0.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2630 -0.5850 -0.0970 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9050 -0.1300 0.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1480 -2.0880 0.2000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1470 -2.5280 0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3980 -2.8030 -0.9250 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6620 -2.5220 -0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0290 -2.4790 -2.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1280 -0.9690 -2.4610 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1270 -0.5220 -2.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8570 -0.3550 -1.3810 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8800 -0.6290 -3.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 -4.2120 -0.7120 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 -4.3480 0.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 -2.3210 1.4290 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 -1.6790 1.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0310 1.7770 0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4750 1.8440 -0.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5250 1.7100 1.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4520 -2.9400 -3.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0280 -2.9330 -2.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3210 -0.8880 -4.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8710 -1.0920 -3.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1250 0.8400 -3.7690 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.8120 1.1150 -4.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2630 1.3780 -3.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4930 1.1030 -2.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 12 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 16 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 14 1 0 0 0 0 9 10 1 0 0 0 0 9 21 1 0 0 0 0 9 22 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 13 23 1 0 0 0 0 13 24 1 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 16 17 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 M CHG 1 25 1 M END