IBS-ZINC02411853 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 52 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 1.0560 -0.5940 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 -0.7750 0.0100 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0010 -0.3000 0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8820 -0.8210 -1.4140 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1650 -0.5700 -2.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4660 -2.2630 -1.5250 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4460 -2.6540 -2.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6160 -3.0860 -0.5600 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8260 -3.6010 -1.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4310 -2.5850 1.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9500 -3.6910 2.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0920 -4.3770 1.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4470 -4.0840 0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5330 -4.6980 -0.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2820 -5.6080 0.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9420 -5.9020 1.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8530 -5.2940 2.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8730 -2.0730 -0.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5970 -2.9490 -0.5750 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1810 -0.7690 -1.0820 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1360 0.0390 -1.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1850 1.2170 -1.7130 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5260 -0.2510 -0.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6560 0.0920 0.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3320 1.3610 1.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4510 1.6760 2.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8950 0.7220 3.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2200 -0.5460 2.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1050 -0.8600 1.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3920 -2.0460 2.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 -4.0760 3.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8030 -4.4710 -1.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1340 -6.0900 -0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5310 -6.6110 2.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5900 -5.5270 3.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6940 0.6440 -1.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2650 -1.0080 -1.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9850 2.1060 0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1970 2.6660 2.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9880 0.9680 4.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5670 -1.2910 3.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3630 -1.8490 1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0470 -2.1480 0.4360 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 48 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 23 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 20 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 10 48 1 0 0 0 0 12 13 2 0 0 0 0 12 35 1 0 0 0 0 12 48 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 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 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 23 24 2 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 43 1 0 0 0 0 28 29 1 0 0 0 0 28 44 1 0 0 0 0 29 30 2 0 0 0 0 29 45 1 0 0 0 0 30 31 1 0 0 0 0 30 46 1 0 0 0 0 31 47 1 0 0 0 0 M END