PUBCHEM-ZINC05117602 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 28 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3420 0.0090 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 1.3180 -0.3820 -0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0580 0.7470 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2540 1.7750 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5370 0.8090 -0.0270 N 0 3 0 0 0 0 0 0 0 0 0 0 4.1900 -0.2190 -0.0380 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1010 1.8890 -0.0270 O 0 5 0 0 0 0 0 0 0 0 0 0 1.8270 -1.7560 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1360 -2.1970 1.4080 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2480 -2.0680 2.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5490 -3.6700 1.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3520 -5.4570 2.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8550 -5.2690 3.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2020 -1.4030 1.9320 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 1.9650 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 -0.6600 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 -2.4180 -0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7370 -1.8000 -0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7730 -4.2660 0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 -3.7860 0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9850 -5.6940 3.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6500 -5.9070 1.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 -5.5920 2.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4990 -5.3860 4.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0250 -1.4690 1.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7290 -4.1270 2.7940 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 17 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 9 10 1 0 0 0 0 9 18 1 0 0 0 0 9 19 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 15 1 0 0 0 0 12 20 1 0 0 0 0 12 21 1 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 22 1 0 0 0 0 13 23 1 0 0 0 0 13 27 1 0 0 0 0 14 24 1 0 0 0 0 14 25 1 0 0 0 0 14 27 1 0 0 0 0 15 26 1 0 0 0 0 M CHG 1 6 1 M CHG 1 8 -1 M END