IBS-ZINC05254241 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 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 3 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 0.7400 -0.5120 1.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3670 -0.6250 2.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0850 -0.1150 1.1720 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1610 0.9710 1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.5000 0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4870 -0.7240 1.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 -0.5180 3.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 0.1270 4.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8830 0.8650 4.7220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 -0.1270 6.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6480 -0.9350 6.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8310 -0.9270 7.8250 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5240 -1.4210 8.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8960 -0.1170 8.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 0.4240 7.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.2910 7.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1740 1.6190 9.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3620 1.0870 10.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 0.2200 9.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1780 2.4610 9.4270 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 0.8020 -1.6000 1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7460 -0.0910 1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9000 -0.2850 3.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -1.7140 2.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0530 -0.4330 1.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9970 -0.3610 0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4100 -1.8100 1.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7570 -0.2120 3.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6570 -1.6020 3.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2480 -1.4900 5.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5910 1.7060 7.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5370 1.3490 11.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2880 -0.1870 10.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 -0.0980 2.4480 N 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 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 10 40 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 18 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 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 M END