NIH-ZINC00277465 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 0 0 0 0 0 0999 V2000 -0.1010 1.6270 -2.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2290 0.2430 -1.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5730 -0.6490 -2.1710 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5810 -1.9810 -1.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0980 -2.4910 -0.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -3.8420 -0.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7740 -4.6940 -1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 -4.1960 -2.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3670 -2.8410 -2.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0450 -2.4080 -3.7630 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3890 -1.5790 -4.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2130 -0.3110 -5.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2780 -1.5170 -4.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4410 -2.7780 -4.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4890 0.4880 -5.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6920 0.1060 -6.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8840 0.8320 -6.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9860 0.4970 -7.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9140 -0.5560 -8.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7330 -1.2820 -8.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6390 -0.9380 -7.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4740 -1.6680 -7.6800 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5060 -2.3320 -9.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5900 -2.7140 -10.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 1.9530 -2.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4310 1.6190 -3.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6990 2.3560 -1.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 0.2750 -0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2800 -0.0650 -1.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7040 -1.8590 -0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 -4.2250 0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8490 -5.7470 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 -4.8920 -2.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3190 -2.1630 -5.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3590 -1.3100 -4.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8040 0.2390 -5.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2580 0.3430 -4.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3310 -0.8730 -3.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2890 -1.7920 -4.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8830 -3.2980 -3.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4920 -3.4580 -4.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7710 1.0200 -4.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8540 1.1440 -6.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9720 1.6650 -5.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9090 1.0660 -7.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7940 -0.7790 -8.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -2.2980 -8.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8730 -1.8990 -10.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4470 -3.0540 -9.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2550 -3.5540 -10.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6440 -0.6910 -5.3880 N 0 3 0 0 0 0 0 0 0 0 0 0 3.6220 -1.2890 -6.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 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 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 12 51 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 13 51 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 15 51 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 51 1 M END