NIH-ZINC00670431 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 1 0 0 0 0 0999 V2000 0.0850 1.9370 -0.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 0.4350 -0.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2950 -0.1490 0.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3270 -1.6590 0.9020 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2780 -1.9580 1.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 -2.3900 -0.3850 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1650 -3.7180 -0.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3020 -4.4800 0.3920 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -4.2000 -1.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 -5.4900 -2.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1090 -5.7830 -3.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2660 -4.8180 -4.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2690 -5.5420 -6.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1320 -6.8410 -5.6980 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 -7.0110 -4.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1620 -2.7270 -2.8840 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -1.6220 -1.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 -0.3030 -1.4720 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7710 -2.1110 1.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4720 -2.4650 3.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4790 -2.8790 3.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7840 -2.9380 3.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0830 -2.5830 2.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0770 -2.1650 1.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4390 0.6270 2.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3540 1.8410 1.9400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 0.0280 3.1920 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8050 0.8780 4.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1020 2.3230 -0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4620 2.2220 -1.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4150 2.3530 0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -6.2980 -1.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3590 -3.7460 -4.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3670 -5.1430 -7.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -7.9550 -3.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5480 -2.4180 3.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2450 -3.1560 5.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5710 -3.2620 4.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1030 -2.6300 1.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3110 -1.8840 0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6420 1.5600 4.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 1.4530 4.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 0.2720 5.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 19 1 0 0 0 0 6 7 1 0 0 0 0 6 17 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 15 2 0 0 0 0 12 13 2 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 40 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 41 1 0 0 0 0 28 42 1 0 0 0 0 28 43 1 0 0 0 0 M END