NCID-ZINC05062928 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 43 0 0 1 0 0 0 0 0999 V2000 0.0450 1.4950 -0.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 0.1050 -0.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 -0.6230 -0.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 0.0350 -0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4360 1.4340 -0.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 2.1600 -0.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6660 -0.7510 -0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2040 -1.0520 -1.4690 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3520 -1.7720 -1.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9220 -2.1550 -0.4300 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7670 -1.9990 -2.7190 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9630 -2.7410 -3.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1270 -2.7830 -4.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3060 -2.2750 -5.3310 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2660 -3.4380 -4.9840 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6160 -3.5780 -6.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9530 -4.3020 -6.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5140 -4.7890 -5.5170 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4500 -4.3610 -7.7780 N 0 0 0 0 0 0 0 0 0 0 0 0 11.7390 -4.9760 -8.1490 C 0 0 3 0 0 0 0 0 0 0 0 0 12.5070 -4.5560 -7.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7180 -6.4970 -8.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5890 -7.0700 -8.6710 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8730 -6.4140 -8.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1180 -4.6330 -9.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1870 -4.0440 -10.2500 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8670 2.0610 -0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9520 -0.4130 -0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1190 -1.7090 -0.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3810 1.9650 -0.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3010 3.2440 -0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 -0.1620 0.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4510 -1.6770 0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2020 -1.6270 -3.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8250 -2.2490 -2.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8700 -3.7580 -2.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9100 -3.8540 -4.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8360 -4.1570 -6.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6840 -2.5830 -6.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9770 -3.9380 -8.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6210 -6.9650 -8.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6470 -6.7820 -6.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2870 -4.9410 -9.9730 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 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 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 25 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 25 26 2 0 0 0 0 25 43 1 0 0 0 0 M CHG 1 43 -1 M END