IBS-ZINC02118343 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 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 0 0 0 0 0 0 0 0 0 0 0.7430 -0.5450 1.2420 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2090 0.2890 1.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1500 -1.2470 2.1670 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2040 -1.9700 1.4040 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8370 -2.8770 0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6980 -0.6770 0.1970 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.3050 -2.2400 2.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6040 -2.6700 2.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3910 -2.8450 3.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8740 -2.5890 4.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5620 -2.1460 4.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7690 -1.9630 3.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3970 -1.4700 3.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4050 -1.3080 4.3720 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0550 -1.8940 6.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4140 -2.9790 6.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6500 -2.7690 5.7550 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9880 -3.2240 5.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8200 -1.4980 0.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6300 -2.6950 0.8410 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9930 -1.0200 0.3310 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0400 -1.9460 -0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2590 -1.1510 -0.5800 C 0 0 3 0 0 0 0 0 0 0 0 0 5.6330 -0.5290 0.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3640 -2.1170 -1.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6170 -1.7130 -2.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0580 -0.2680 -2.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9010 -0.3260 -1.7010 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6480 -0.5260 -1.2830 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 -4.0140 -2.8710 1.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4120 -3.1830 3.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0550 -2.6430 7.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1270 -3.7930 6.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5730 -3.3310 6.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5220 -2.5030 4.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9660 -4.1900 5.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4960 -3.3250 6.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1450 -0.0620 0.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3260 -2.5910 0.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6640 -2.5560 -0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2680 -1.9810 -0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0180 -3.1490 -0.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6830 -1.7250 -2.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0670 -2.3620 -3.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7920 0.4380 -2.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7670 0.0030 -3.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6760 -0.1690 -1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6420 -1.6160 -1.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -0.1650 -2.1440 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 8 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 21 1 0 0 0 0 5 6 1 0 0 0 0 5 15 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 2 0 0 0 0 12 19 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 17 18 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 30 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 29 51 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