IBS-ZINC04785587 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 1 0 0 0 0 0999 V2000 0.1700 0.6600 -1.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 -0.7680 -0.7830 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 -1.1790 0.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1680 -2.5400 0.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2970 -3.4570 -0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3360 -4.6540 -0.0160 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3770 -2.9970 -1.5050 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3300 -1.6790 -1.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4010 -1.3010 -2.9200 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -3.9480 -2.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -2.6570 2.1990 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 -1.3950 2.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.5320 1.6970 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1620 -1.0690 4.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3920 0.3230 4.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4900 0.4110 5.9420 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2600 -0.2740 6.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8540 1.8410 6.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0600 1.8970 7.7610 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7670 0.0570 6.5220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -3.9010 2.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3630 -4.3420 3.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0480 -5.0310 2.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3540 -5.4360 2.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9730 -5.1520 3.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2900 -4.4640 4.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9830 -4.0640 4.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1230 -3.2070 5.6540 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.4420 -5.3080 1.0470 F 0 0 0 0 0 0 0 0 0 0 0 0 1.1830 1.0630 -1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2720 0.7940 -2.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4310 1.1850 -0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4780 -4.2320 -2.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0720 -3.4830 -3.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0430 -4.8350 -2.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 -1.7600 4.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4360 0.9410 4.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3210 0.6780 3.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 2.5140 6.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7670 2.1430 5.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2940 2.7760 8.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 0.6260 6.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 -4.6750 2.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5510 -3.7340 3.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8880 -5.9730 1.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9920 -5.4670 3.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7760 -4.2420 5.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 3 4 2 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 21 1 0 0 0 0 12 13 2 0 0 0 0 12 14 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 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 20 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 29 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 M END