IBS-ZINC05196295 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 55 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5240 -1.7810 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4770 -0.3320 -1.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1100 -0.8960 -2.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0390 -1.8000 -2.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7100 -2.3280 -3.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4200 -1.9840 -4.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4630 -1.1120 -4.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8310 -0.5460 -3.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9010 0.3600 -3.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2290 0.8880 -2.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5180 0.5470 -1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8850 1.1090 -0.0380 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5340 0.5330 1.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4980 -0.3440 1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1650 -0.9180 2.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9120 -0.5580 3.5430 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9320 0.3240 3.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2200 0.8370 2.2490 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6050 -1.1240 4.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3930 -2.3930 5.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6220 -2.4800 5.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9760 -3.8490 5.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9440 -4.5160 5.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9850 -3.6300 4.7280 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4800 -2.0760 -1.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8860 -3.0230 -3.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1380 -2.4170 -5.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0050 -0.8550 -5.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4610 0.6350 -4.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0510 1.5850 -2.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5160 0.6020 4.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8730 -0.4060 5.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5390 -1.3440 4.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2220 -1.6620 5.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9000 -4.2770 5.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8920 -5.5840 4.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1680 -1.7720 2.5450 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6520 -2.0150 1.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 21 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 2 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 49 2 0 0 0 0 23 24 1 0 0 0 0 23 26 1 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 27 28 2 0 0 0 0 27 31 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 29 30 2 0 0 0 0 29 47 1 0 0 0 0 30 31 1 0 0 0 0 30 48 1 0 0 0 0 49 50 1 0 0 0 0 M END