IBS-ZINC02414472 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 58 0 0 1 0 0 0 0 0999 V2000 0.1170 0.8630 0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.6310 -0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 -0.8180 -1.5240 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8570 -0.2970 -1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 -2.3090 -1.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -0.2700 -2.5700 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4640 0.7640 -3.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2660 1.2880 -4.2760 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 0.8260 -4.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9980 -0.2410 -3.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1930 -0.8010 -2.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5930 -1.7350 -2.1050 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3450 -0.5260 -4.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5700 0.4070 -5.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4440 1.1980 -5.4660 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2820 2.2840 -6.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6680 1.7310 -7.7240 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2670 0.8970 -8.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6030 2.8400 -8.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0990 2.9380 -9.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4360 1.5600 -8.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3220 1.2930 -7.4740 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7120 0.3950 -6.0110 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6570 -0.4970 -5.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8820 -0.5250 -6.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8290 -1.4400 -6.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6060 -2.3550 -5.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4340 -2.3580 -4.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4300 -1.4270 -4.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2700 -1.4100 -3.9810 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8380 1.3300 -3.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1120 1.3080 0.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4840 1.3490 -0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 0.9960 1.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8340 -1.1160 0.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7630 -1.0760 -0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6030 -2.4420 -2.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7720 -2.7170 -1.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1700 -2.8300 -1.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2560 2.7220 -6.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6260 3.0480 -6.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1830 2.5580 -9.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9610 3.7850 -8.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 3.0650 -10.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3780 3.7480 -8.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2390 0.7970 -9.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5010 1.6170 -8.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0710 0.1770 -7.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7680 -1.4580 -6.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3740 -3.0700 -4.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2750 -3.0710 -3.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5790 0.7380 -3.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8760 2.3620 -3.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0520 1.2980 -2.0090 H 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 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 2 0 0 0 0 13 14 1 0 0 0 0 13 30 2 0 0 0 0 14 15 1 0 0 0 0 14 23 2 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 22 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 28 2 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 M END