NCID-ZINC05823978 MOE2007 3D CORINA 3.40 0006 02.08.2006 70 70 0 0 1 0 0 0 0 0999 V2000 0.2440 1.3330 -0.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 -0.1890 -0.2020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6070 -0.6600 -1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2470 -0.6220 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6090 -1.1280 1.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1260 -0.4490 -1.0400 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8550 0.0180 -1.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4920 -0.9660 -0.9170 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8420 -0.8260 0.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4110 -0.2100 -1.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5050 1.2330 -1.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9790 1.5970 -0.4240 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1730 2.1180 -2.2200 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5060 -2.4340 -1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4770 -2.9930 -1.5720 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6620 -3.1250 -1.2130 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4850 -2.6770 -0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6760 -4.5520 -1.5440 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9510 -4.7480 -2.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0730 -4.9500 -2.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3880 -4.2280 -3.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7640 -4.6210 -3.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4250 -5.3990 -3.1610 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3160 -5.3550 -0.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0730 -4.7900 0.7250 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2660 -6.7000 -0.3880 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9410 -0.5800 0.9470 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3160 -0.8550 0.6740 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4180 -1.2260 -0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8330 -1.9090 1.6570 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2910 -2.8430 1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3260 -2.1390 1.4080 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4710 -2.5280 0.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0270 -0.9020 1.5460 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6180 0.1070 0.6210 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7670 -0.2520 -0.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1370 0.4280 0.8360 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8120 1.1640 0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9500 0.9510 2.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4520 1.3710 0.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8200 1.1010 0.5280 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8290 -3.0810 2.3580 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6320 -1.4390 3.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4810 -1.7160 3.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -2.3540 3.1190 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2740 -1.2320 5.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2810 1.6460 -0.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3310 1.6310 -1.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1760 1.8040 0.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0050 -0.2660 -2.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4040 -0.6600 -1.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5930 1.8270 -3.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2330 3.0470 -1.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1080 -6.0280 -2.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8090 -4.6720 -1.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3530 -3.1500 -3.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6520 -4.5060 -4.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4610 -7.1510 -1.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0340 -7.2170 0.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4420 1.7660 2.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0810 2.1680 0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3730 1.6800 1.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4070 1.8600 0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7710 -3.2750 2.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3260 -0.9280 3.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8130 -0.2450 5.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6230 -1.9280 5.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2360 -1.1750 5.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2550 -4.1060 -4.9450 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.1420 -4.3880 -5.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 47 1 0 0 0 0 1 48 1 0 0 0 0 1 49 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 27 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 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 10 11 1 0 0 0 0 10 50 1 0 0 0 0 10 51 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 52 1 0 0 0 0 13 53 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 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 24 1 0 0 0 0 20 21 1 0 0 0 0 20 54 1 0 0 0 0 20 55 1 0 0 0 0 21 22 1 0 0 0 0 21 56 1 0 0 0 0 21 57 1 0 0 0 0 22 23 2 0 0 0 0 22 69 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 58 1 0 0 0 0 26 59 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 37 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 43 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 42 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 35 37 1 0 0 0 0 35 40 1 0 0 0 0 37 38 1 0 0 0 0 37 39 1 0 0 0 0 39 60 1 0 0 0 0 40 41 1 0 0 0 0 40 61 1 0 0 0 0 40 62 1 0 0 0 0 41 63 1 0 0 0 0 42 64 1 0 0 0 0 43 44 1 0 0 0 0 43 65 1 0 0 0 0 44 45 2 0 0 0 0 44 46 1 0 0 0 0 46 66 1 0 0 0 0 46 67 1 0 0 0 0 46 68 1 0 0 0 0 69 70 1 0 0 0 0 M END