PUBCHEM-ZINC06933101 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0220 -0.6560 1.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 0.0240 2.3110 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -0.6760 3.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 0.0030 4.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -0.7610 5.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -2.0860 5.8290 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -2.6800 4.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -2.0050 3.5190 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 0.1410 6.9520 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 1.3900 6.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 1.3060 5.1060 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -0.1790 8.3810 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5010 -1.0800 8.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5390 -0.3940 8.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5350 0.2780 10.2520 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1620 -0.4050 11.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 1.4460 10.0150 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0560 2.2870 9.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4580 0.9140 9.1310 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0900 1.8810 11.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9090 3.0300 11.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8340 0.7660 10.5930 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.7300 -1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -1.7360 1.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 0.9940 2.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 -3.7590 4.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 2.3120 6.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7680 -1.4560 8.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2410 0.1060 8.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7010 1.0690 11.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 2.1260 12.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3440 3.3620 11.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5110 0.0770 10.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0270 -0.8960 -1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 -1.6900 -1.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 -0.1440 -2.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 13 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 2 0 0 0 0 12 32 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 21 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 24 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 23 37 1 0 0 0 0 24 38 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 M CHG 1 2 1 M END