NIH-ZINC00245596 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 44 0 0 1 0 0 0 0 0999 V2000 0.9880 1.8390 -0.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 0.5170 1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5490 2.8820 1.0330 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0340 2.6230 1.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 3.6660 1.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5960 2.8840 2.2090 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8450 3.3110 2.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2560 4.3440 1.9910 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7130 2.5230 3.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2450 1.3350 3.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0610 0.6040 4.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3450 1.0420 5.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8210 2.2140 4.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0150 2.9600 3.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4820 4.1090 3.1110 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8180 4.4900 3.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4800 3.7280 0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4910 4.4590 0.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3240 5.2230 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1220 5.2300 -1.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1500 4.5220 -1.9020 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3350 3.7890 -1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0520 1.0400 -1.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8700 1.8120 0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9380 2.8020 -1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 0.6290 1.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -0.4100 0.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9050 0.4890 1.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2570 3.8600 0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4810 4.6130 1.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2680 2.0600 2.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2450 0.9910 3.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6980 -0.3140 5.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9780 0.4630 5.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8230 2.5490 4.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8990 4.6270 4.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5100 3.7100 3.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0660 5.4240 2.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6260 4.4340 1.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1220 5.8040 0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7670 5.8220 -1.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 3.2260 -1.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2180 1.6540 0.2980 N 0 0 0 0 0 0 0 0 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 1 43 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 43 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 17 1 0 0 0 0 3 43 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 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 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 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 22 42 1 0 0 0 0 M END