PUBCHEM-ZINC05336157 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 1 0 0 0 0 0999 V2000 -0.1280 1.5160 -0.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0770 0.0110 -0.1120 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8340 -0.5120 -0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5300 -0.4640 1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6710 -1.9150 1.3180 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4120 -2.5880 2.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5820 -3.9780 2.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3160 -4.7160 3.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9010 -4.0600 4.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7590 -2.6780 4.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0210 -1.9560 3.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6610 -4.8240 5.1700 N 0 3 0 0 0 0 0 0 0 0 0 0 3.7730 -6.0450 4.9950 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1480 -4.2020 6.1250 O 0 5 0 0 0 0 0 0 0 0 0 0 0.7890 2.0570 0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4350 1.8320 -1.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9100 1.8250 0.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4840 0.0230 1.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2030 -0.1560 2.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1540 -2.4930 0.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1320 -4.5100 1.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4130 -5.7920 2.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2030 -2.1450 5.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9170 -0.8850 3.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 -0.3580 -1.1190 N 0 3 0 0 0 0 0 0 0 0 0 0 2.0120 0.1320 -0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 -0.1530 -2.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3380 -1.3630 -1.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 25 1 0 0 0 0 4 5 1 0 0 0 0 4 18 1 0 0 0 0 4 19 1 0 0 0 0 5 6 1 0 0 0 0 5 20 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 23 1 0 0 0 0 11 24 1 0 0 0 0 12 13 2 0 0 0 0 12 14 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 12 1 M CHG 1 14 -1 M CHG 1 25 1 M END