CHEMBRIDGE-ZINC02886410 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 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 1.0610 -0.5960 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2590 -0.7550 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2420 -2.1560 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 -2.8510 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6320 -2.1690 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6530 -0.7760 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4820 -0.0730 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8250 -2.8800 0.0310 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1040 -2.1640 0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2530 -3.1740 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5680 -2.4390 0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5850 -1.2260 0.0740 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.8330 -3.1920 0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0550 -2.5130 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2360 -3.2260 0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2120 -4.6090 0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0070 -5.2890 0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8180 -4.5900 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4840 -5.3670 0.0940 N 0 3 0 0 0 0 0 0 0 0 0 0 -14.5470 -4.7720 0.1070 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.4680 -6.5840 0.0870 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3010 -2.6860 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4060 -3.9310 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5970 -0.2510 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 1.0070 0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8120 -3.8490 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1620 -1.5440 0.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1780 -1.5340 -0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1950 -3.7950 -0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1790 -3.8050 0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0750 -1.4330 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1800 -2.7020 0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9970 -6.3680 0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8780 -5.1220 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END