IBS-ZINC02304062 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 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 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -0.4900 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8350 -0.9340 -1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -0.4290 -2.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2150 0.0460 -2.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4850 -0.0580 -4.0600 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3190 0.2140 -4.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4110 -0.6030 -4.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -0.8540 -3.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8130 -1.4030 -4.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0170 -1.6960 -5.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 -1.4430 -6.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 -0.9080 -6.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2000 -2.2320 -5.9450 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3430 -2.5110 -7.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 -0.2410 2.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -0.8320 3.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0010 -0.2260 3.7170 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7830 -0.4760 2.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0480 0.1150 1.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6770 -0.6890 4.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9600 -0.2360 5.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6250 -0.6950 6.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0150 -1.6050 7.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7380 -2.0580 6.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0650 -1.5990 5.7010 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 -1.8910 0.4400 -2.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5910 -1.5980 -3.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1820 -1.6740 -7.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 -0.7150 -6.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5780 -3.2220 -7.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2310 -1.5870 -7.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3300 -2.9340 -7.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0490 -0.7100 2.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 0.8330 2.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -0.6230 4.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7650 -1.9100 3.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7630 -0.0060 2.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9060 -1.5500 2.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9490 1.1930 1.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6120 -0.0940 0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4380 0.4750 4.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6230 -0.3430 6.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5370 -1.9620 7.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2640 -2.7690 7.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0660 -1.9500 5.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 -0.4910 1.1920 N 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 52 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 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 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 18 52 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 52 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 51 1 0 0 0 0 M END