IFLAB-ZINC05044050 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 1 0 0 0 0 0999 V2000 0.0310 1.6950 -0.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4150 0.9470 0.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4610 0.6420 1.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7980 1.0840 1.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2360 1.8370 0.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3530 2.1320 -0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6480 2.2700 0.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5200 1.4100 0.6510 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7910 3.6250 0.3880 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9840 4.3450 0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2490 3.7680 0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4100 4.5080 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3250 5.8400 -0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0750 6.4350 -0.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9010 5.6920 -0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5680 6.3230 -0.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5810 5.8630 0.0270 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5050 7.3830 -1.4320 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2710 8.1160 -1.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1230 9.2870 -0.7030 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3180 8.9660 0.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7660 9.9640 -0.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0840 11.3480 -0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4540 11.5940 -0.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0900 10.3150 -1.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6670 0.7740 3.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4120 1.7120 3.5230 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.6460 1.9290 -1.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4430 0.5970 0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1010 0.0580 2.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6960 2.6860 -1.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9450 4.2060 0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3630 2.7420 0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3820 4.0410 0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2320 6.4170 -0.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0470 7.4860 -0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3190 7.6930 -1.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3200 8.4720 -2.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4250 7.4270 -1.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4230 10.0240 -1.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 9.4530 -0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 12.1040 -0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 11.3360 0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 12.0360 -1.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0710 12.2480 -0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5310 -0.3770 3.6310 O 0 0 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 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 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 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 40 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 2 0 0 0 0 M CHG 1 27 -1 M END