NIH-ZINC05137872 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1240 -0.9400 -1.4230 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9010 0.0640 -1.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9460 0.5840 -1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7550 1.5950 -1.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5160 2.0890 -3.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4810 1.5710 -3.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6770 0.5650 -3.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3640 -0.0670 -4.2360 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2710 -0.1080 -3.3300 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7910 -1.7660 -4.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0080 -2.2840 -5.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3380 -3.6180 -5.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4520 -4.4380 -4.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2400 -3.9320 -3.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9080 -2.5800 -3.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7040 -2.0640 -1.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0540 -2.7740 -1.1980 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8610 2.1430 -0.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0660 1.7120 0.2050 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 -0.1100 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5990 -1.6640 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1290 0.2010 -0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1390 2.8730 -3.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2950 1.9520 -4.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9180 -1.6460 -6.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5080 -4.0190 -6.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7090 -5.4800 -4.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3300 -4.5770 -2.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6420 3.1210 -1.4110 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3520 3.4480 -0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 23 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 34 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 12 13 2 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 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 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 25 26 2 0 0 0 0 25 41 1 0 0 0 0 41 42 1 0 0 0 0 M END