IBS-ZINC02150446 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 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 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4990 -1.7570 -0.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9650 -2.1870 -0.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1370 -3.5340 -1.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5410 -3.9460 -1.2090 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9300 -5.1100 -1.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1180 -5.8160 -2.3260 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3750 -5.5330 -1.6960 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.6910 -5.6200 -0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2670 -4.5180 -2.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3570 -5.1530 -3.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1090 -6.6260 -3.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3650 -7.5110 -4.3980 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5640 -6.8110 -2.3930 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2070 -8.1180 -1.8350 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.6930 -7.9900 -0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4460 -8.9560 -1.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5880 -8.7980 -0.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5770 -9.7670 -0.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4200 -10.8950 -1.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2780 -11.0640 -2.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2770 -10.0920 -2.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9720 -9.9840 -3.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5170 -10.8080 -3.8890 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3570 -8.8420 -2.7660 O 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1990 -1.6620 -1.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8760 -2.5050 -0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2650 -2.2820 0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5880 -1.4390 -1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8370 -3.4400 -2.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5140 -4.2830 -0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1910 -3.3820 -0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2530 -4.4510 -1.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7910 -3.5380 -2.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3480 -4.9970 -4.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5890 -4.7390 -4.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7140 -7.9190 -0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4740 -9.6420 -0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1950 -11.6470 -1.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1580 -11.9460 -3.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 42 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 17 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 28 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 M END