IBS-ZINC04844410 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 40 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 0.4990 -0.3710 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 -0.5380 1.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2900 -1.3150 1.9520 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2290 -1.6940 0.9230 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8450 -2.5380 0.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3420 -0.5240 0.0800 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5850 -2.0420 1.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4540 -3.2540 2.3530 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1340 -3.2720 3.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8630 -2.2580 4.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5660 -2.5680 5.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5340 -3.8890 6.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8000 -4.9080 5.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1020 -4.6080 4.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4260 -5.4330 2.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6390 -4.5430 1.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9710 -5.0470 0.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0910 -6.4070 0.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8840 -7.2850 1.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5460 -6.8060 2.7450 C 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 1.5560 -1.1680 0.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 0.2900 1.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9210 -1.2180 2.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3120 -2.2140 0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8840 -1.2260 4.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3560 -1.7770 6.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -4.1200 7.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7750 -5.9360 5.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1350 -4.3720 -0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3500 -6.7930 -0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9810 -8.3490 1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3870 -7.4910 3.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 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 5 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 5 6 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 10 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 2 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 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 34 1 0 0 0 0 20 21 2 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 22 37 1 0 0 0 0 M END