NIH-ZINC04388608 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 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 3 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8360 -1.1470 -0.9380 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2040 -0.3020 1.0790 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5790 -0.8090 1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2560 -0.4200 2.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3770 1.0020 2.4780 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0000 1.4720 3.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6710 -0.4650 -1.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0050 -0.6520 -1.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5830 -0.4290 -0.0400 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7550 -1.1220 -2.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1140 -1.3530 -2.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4260 -1.7920 -3.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2410 -1.8210 -4.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2230 -1.4170 -3.4920 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8100 -1.3110 -3.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5840 -2.2670 -5.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9110 -2.4820 -5.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4180 -2.1980 -4.4100 O 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 -1.8650 0.1950 1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1320 -0.3770 0.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5660 -1.8950 0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2470 -0.8720 2.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6550 -0.7770 3.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4140 1.1550 4.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0540 2.5600 3.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0060 1.0600 3.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8110 -1.2190 -1.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6100 -0.3130 -4.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 -2.0520 -4.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1890 -1.4910 -2.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9060 -2.4080 -6.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4820 -2.8290 -6.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 11 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 26 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 22 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 M END