IFLAB-ZINC04341552 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.7040 -0.4850 1.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 -1.8150 1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3350 -2.5530 0.4930 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5270 -2.3880 2.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 -3.8510 2.4450 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0920 -4.5830 3.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6340 -4.0300 4.3480 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0730 -6.0880 3.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9320 -6.7760 4.7740 S 0 0 0 0 0 0 0 0 0 0 0 0 2.7620 -8.4970 4.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2970 -9.4610 5.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0130 -9.4080 6.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2620 -10.6270 6.9180 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7300 -11.5340 5.9920 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1290 -10.8220 4.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4760 -11.1420 3.8780 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9950 -10.2070 3.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1220 -8.9180 3.3510 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8030 -12.9310 6.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9310 -13.5380 6.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 -14.9140 6.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9460 -15.6900 6.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8210 -15.0870 5.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7450 -13.7100 5.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0160 -17.0370 6.3210 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5600 -2.0380 2.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0270 -2.0640 3.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -4.2930 1.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0410 -6.4380 3.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5730 -6.4120 2.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3060 -8.5080 7.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4720 -10.5040 2.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7530 -12.9330 6.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8780 -15.3870 7.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -15.6940 5.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8650 -13.2400 5.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 20 2 0 0 0 0 13 14 1 0 0 0 0 13 17 2 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 26 43 1 0 0 0 0 M END