IBS-ZINC02445459 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 1 0 0 0 0 0999 V2000 0.3750 0.6740 0.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1520 -0.7740 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 -0.9730 -1.4920 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0940 -0.0810 -2.4290 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0670 0.2540 -3.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 0.8080 -4.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1470 1.0550 -5.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3860 0.7490 -4.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4640 0.1940 -3.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3080 -0.0540 -2.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1120 -0.5820 -1.5320 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5550 0.9990 -5.4930 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5280 0.9710 -6.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7280 1.0060 -7.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6400 0.9750 -9.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4480 0.9140 -9.5780 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3430 0.8820 -8.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3730 0.9040 -7.5250 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1110 0.8190 -9.4920 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9110 0.7840 -10.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5770 0.7250 -11.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 0.7220 -9.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 0.7720 -8.8710 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 0.6710 -12.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0340 1.0750 -6.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1030 0.9430 -5.7350 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1540 1.2830 -7.6620 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4070 1.3390 -6.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5580 1.5810 -7.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 -2.4270 -1.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4430 0.8900 0.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1250 1.3470 -0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 0.8150 1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6520 -1.4480 0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9160 -0.9900 -0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 1.0460 -5.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0860 1.4860 -6.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4280 -0.0450 -3.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3840 1.1930 -5.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5330 1.0010 -9.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6780 0.8020 -11.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1270 0.6810 -9.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2260 -0.3690 -12.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0830 1.1460 -12.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5030 1.1960 -13.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3690 2.1530 -6.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5660 0.3950 -6.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5970 0.7680 -8.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4000 2.5250 -8.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4990 1.6230 -7.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4960 -2.6860 -1.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9770 -2.5490 -2.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0890 -3.0820 -1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 23 1 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 M END