NIH-ZINC04586467 MOE2007 3D CORINA 3.40 0006 02.08.2006 65 68 0 0 1 0 0 0 0 0999 V2000 0.4600 1.1250 -0.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 -0.2960 -0.4950 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7650 -1.0170 -1.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 -0.3710 -2.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7390 -1.1050 -3.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6460 -2.4840 -3.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1120 -3.1370 -2.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6750 -2.4070 -1.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 -3.0660 -0.4390 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 -3.8530 -0.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6430 -4.4910 0.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5520 -4.5530 1.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 -3.9150 0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1940 -6.0310 2.2580 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5270 -5.2960 2.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 -6.9250 2.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 -7.5540 4.0950 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 -8.3260 4.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2970 -8.5000 4.5500 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4130 -8.9740 6.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 -9.7890 6.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 -10.4460 8.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3720 -9.3640 9.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4740 -8.5490 8.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9140 -7.8920 7.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3640 -6.8770 1.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5030 -6.9540 2.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5550 -7.7440 2.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4350 -8.4250 0.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3360 -8.3280 0.2580 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3180 -7.5810 0.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5100 1.3880 -0.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 1.4930 -1.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 1.5760 0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3740 0.7060 -2.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1560 -0.5990 -4.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9900 -3.0540 -4.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 -4.2140 -2.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7820 -3.2000 -1.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7550 -4.6340 -1.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9570 -3.7090 1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5050 -5.0990 0.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 -5.2060 1.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2630 -3.7720 2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4660 -4.6970 -0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0130 -3.3070 0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1700 -7.6970 2.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7480 -6.3220 3.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5850 -7.4160 4.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2400 -9.6320 5.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0450 -10.5600 6.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5140 -9.1300 7.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6980 -11.1040 7.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9130 -11.0270 8.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7710 -9.8320 9.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 -8.7060 9.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3000 -9.2070 8.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8300 -7.7780 9.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0880 -7.2330 7.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6980 -7.3110 6.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5680 -6.4110 3.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4570 -7.8270 2.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2500 -9.0430 0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4370 -7.5230 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6320 -5.3400 1.0900 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 11 65 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 12 65 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 26 1 0 0 0 0 14 65 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 17 49 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 20 50 1 0 0 0 0 21 22 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 22 23 1 0 0 0 0 22 53 1 0 0 0 0 22 54 1 0 0 0 0 23 24 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 24 25 1 0 0 0 0 24 57 1 0 0 0 0 24 58 1 0 0 0 0 25 59 1 0 0 0 0 25 60 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 61 1 0 0 0 0 28 29 1 0 0 0 0 28 62 1 0 0 0 0 29 30 2 0 0 0 0 29 63 1 0 0 0 0 30 31 1 0 0 0 0 31 64 1 0 0 0 0 M END