IBS-ZINC01752838 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 1 0 0 0 0 0999 V2000 0.1030 1.4000 0.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1090 -0.1050 0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 -0.9500 1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 -2.2600 0.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -2.1380 -0.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -0.8300 -0.9570 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -3.2740 -1.6400 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4390 -4.1820 -1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3910 -3.5060 -2.1230 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8260 -4.9180 -1.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2440 -5.2160 -1.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1610 -5.7180 -2.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3620 -5.8460 -1.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2100 -5.4390 -0.6110 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9110 -5.4300 0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9380 -5.0650 -0.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3630 -4.5610 0.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6050 -6.3330 -2.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6200 -6.6650 -3.6970 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7310 -6.4130 -1.7890 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9230 -6.9040 -2.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8670 -6.0470 -3.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0030 -5.8080 -1.7740 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3260 -3.2730 -3.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2410 -3.3500 -4.4030 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0910 -2.9300 -3.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5080 -2.6790 -5.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8430 -2.9350 -2.8220 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2780 -2.6390 -2.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0690 -3.9330 -2.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9250 -3.1690 -1.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2940 -4.8040 -3.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 1.7690 0.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4500 1.8080 -0.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3720 1.7110 1.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2040 -0.6790 2.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 -3.1820 1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5440 -3.4900 0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8390 -5.0790 1.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2900 -4.7510 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7430 -7.9130 -2.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7540 -6.9180 -1.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1670 -6.2490 -3.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5510 -7.0880 -4.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7660 -5.8950 -4.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0720 -5.3980 -4.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0690 -2.7920 -1.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5190 -1.9400 -3.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5390 -2.1940 -1.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8280 -4.6320 -2.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8080 -4.3780 -3.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7140 -3.9420 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3760 -2.2620 -1.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9940 -2.9560 -1.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0140 -5.0860 -4.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0970 -5.6360 -2.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3560 -4.5570 -3.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5080 -3.6360 -2.9650 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 28 1 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 9 47 1 0 0 0 0 10 11 1 0 0 0 0 10 23 2 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 58 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 31 58 1 0 0 0 0 32 55 1 0 0 0 0 32 56 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 M END