IBS-ZINC06624388 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 61 0 0 1 0 0 0 0 0999 V2000 -0.2300 1.5440 -0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 0.0520 -0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9510 -0.3530 -1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 -0.3180 1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -0.0890 2.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -0.5700 3.6350 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6150 0.1620 4.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0890 1.4380 4.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0490 1.9560 4.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5170 1.1990 6.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0320 -0.0900 6.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0740 -0.5970 5.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3930 -1.9420 5.4490 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4630 -1.8390 4.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3180 -2.6970 3.8090 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3340 -3.0960 5.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3050 -4.2710 6.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3560 -5.1000 5.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8290 -6.3840 5.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9200 -6.9340 5.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5400 -6.2070 4.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0910 -4.9260 3.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9990 -4.4000 4.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3600 -3.1860 4.3830 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6270 -2.4800 3.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2760 -8.1880 5.6170 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3510 -8.8200 4.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3040 -4.5100 7.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1010 -3.5650 6.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 2.1560 -0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6880 1.7900 -1.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9410 1.8360 0.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8410 -0.5110 -0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9070 0.1820 -1.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 -1.4270 -1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4290 -0.1310 -2.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1190 -1.3770 1.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7680 0.2490 1.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2620 0.9680 2.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9570 -0.6360 2.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7430 2.0330 3.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4440 2.9560 4.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2700 1.6230 6.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4170 -0.6700 7.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3500 -6.9550 6.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3890 -6.6070 3.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5810 -4.3690 3.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1170 -8.9610 3.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2840 -8.2610 5.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4930 -9.8100 5.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9560 -5.5490 7.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7850 -4.3400 8.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 -3.8440 6.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5050 -3.5550 7.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5600 -2.1440 6.7150 N 0 3 0 0 0 0 0 0 0 0 0 0 1.1200 -1.8400 7.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2560 -1.5200 6.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 14 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 10 11 2 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 13 55 1 0 0 0 0 14 15 2 0 0 0 0 16 17 2 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 28 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 26 1 0 0 0 0 21 22 2 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 26 27 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 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 28 52 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 55 56 1 0 0 0 0 55 57 1 0 0 0 0 M CHG 1 55 1 M END