CHEMBRIDGE-ZINC02133910 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 61 0 0 1 0 0 0 0 0999 V2000 -0.0130 1.5210 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -0.0090 -0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5150 -0.3680 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7300 -0.5020 1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 -1.2050 2.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0190 -0.1610 1.4260 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6640 -0.5370 2.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3640 -1.7520 3.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0030 -2.1200 4.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9410 -1.2800 4.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2410 -0.0680 4.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6100 0.3030 3.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3710 -0.5130 0.0110 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0490 -0.6510 -1.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5200 -0.3580 -2.1980 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4640 -1.1700 -1.1340 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4940 -2.1290 -0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3660 -0.1700 -0.4020 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2300 0.8510 -0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8310 -0.6370 -0.5020 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.4880 0.1620 -0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2380 -1.0590 -1.8820 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.1720 -1.6190 -1.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1850 -1.9210 -2.6030 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.1950 -2.9620 -2.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9180 -1.3370 -2.4720 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5930 -1.7550 -3.9890 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0300 -0.3870 -4.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4170 0.0480 -2.7760 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2090 -0.2840 -5.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8800 0.4900 -4.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8750 -1.7240 0.4420 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0230 -1.2900 1.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0830 -0.3060 1.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2560 -2.4890 2.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8730 -0.6630 2.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.8960 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 1.8770 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5240 1.8790 0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4980 0.3440 0.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6320 -2.4090 2.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7700 -3.0650 4.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4390 -1.5690 5.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9740 0.5860 4.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8490 1.2470 2.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7950 -0.7480 0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0210 -0.9240 -4.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5540 0.7490 -5.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8910 -0.6030 -6.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5790 0.1650 -5.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2060 1.5300 -4.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0340 0.4010 -3.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6460 -2.9320 1.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6120 -2.1580 2.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9620 -3.2300 2.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5840 -1.4000 3.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2260 -0.3360 3.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4150 0.1940 2.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 13 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 40 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 45 1 0 0 0 0 13 14 1 0 0 0 0 13 46 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 26 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 34 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 32 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 29 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 31 1 0 0 0 0 30 47 1 0 0 0 0 30 48 1 0 0 0 0 30 49 1 0 0 0 0 31 50 1 0 0 0 0 31 51 1 0 0 0 0 31 52 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 33 36 1 0 0 0 0 35 53 1 0 0 0 0 35 54 1 0 0 0 0 35 55 1 0 0 0 0 36 56 1 0 0 0 0 36 57 1 0 0 0 0 36 58 1 0 0 0 0 M END