NIH-ZINC04388794 MOE2007 3D CORINA 3.40 0006 02.08.2006 71 71 0 0 1 0 0 0 0 0999 V2000 -3.3060 -0.0580 -2.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7870 -0.3860 -0.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6640 0.5850 -0.4260 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0080 1.6090 -0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2690 0.3760 1.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4520 0.3260 -1.3230 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7610 0.3510 -2.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 1.3890 -1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6030 1.1190 -0.4750 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3910 2.6410 -1.5400 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4430 3.6500 -1.3910 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0660 3.4010 -0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3050 3.6790 -2.6550 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0140 4.5040 -2.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0670 2.3580 -2.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4080 3.8700 -3.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8760 5.3040 -3.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8150 5.0040 -1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3860 5.1370 -1.2820 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5880 6.0660 -0.8810 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0370 6.0300 -0.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4830 7.4700 -0.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1680 8.1400 0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1220 7.4580 -0.7490 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0980 7.9440 -1.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2430 7.4960 -0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 6.6900 0.7470 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1400 8.4270 -0.4920 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 -0.9900 -1.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3910 -2.0950 -1.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3150 -2.0000 -2.3790 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 -3.3040 -1.3100 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4650 -4.4500 -1.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3250 -4.2900 -3.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 -5.7260 -1.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9470 -4.5420 -1.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4710 -0.0290 -2.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0160 -0.8230 -2.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8010 0.9130 -2.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6000 -0.2910 -0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4050 -1.4070 -0.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -0.6480 1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4680 1.0680 1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1320 0.5610 1.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4470 2.8750 -1.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3610 1.5460 -2.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7590 2.4180 -3.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6260 2.1710 -1.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9840 3.6800 -4.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 3.1730 -3.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4170 5.5050 -4.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1330 5.4290 -3.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6990 5.9990 -3.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2550 5.3720 0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5550 5.6760 -1.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2270 7.4700 0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8680 7.9680 -1.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9740 7.9160 1.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1930 9.2160 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9070 9.0730 -1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0180 8.4520 -0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -1.0650 -0.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -4.2240 -3.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7710 -5.1500 -3.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 -3.3810 -3.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1520 -5.8400 -0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1940 -6.5860 -2.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3070 -5.6600 -1.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4580 -3.6330 -1.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3930 -5.4020 -2.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0470 -4.6560 -0.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 40 1 0 0 0 0 2 41 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 5 44 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 29 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 18 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 16 49 1 0 0 0 0 16 50 1 0 0 0 0 17 51 1 0 0 0 0 17 52 1 0 0 0 0 17 53 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 24 1 0 0 0 0 21 22 1 0 0 0 0 21 54 1 0 0 0 0 21 55 1 0 0 0 0 22 23 1 0 0 0 0 22 56 1 0 0 0 0 22 57 1 0 0 0 0 23 24 1 0 0 0 0 23 58 1 0 0 0 0 23 59 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 60 1 0 0 0 0 28 61 1 0 0 0 0 29 30 1 0 0 0 0 29 62 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 33 36 1 0 0 0 0 34 63 1 0 0 0 0 34 64 1 0 0 0 0 34 65 1 0 0 0 0 35 66 1 0 0 0 0 35 67 1 0 0 0 0 35 68 1 0 0 0 0 36 69 1 0 0 0 0 36 70 1 0 0 0 0 36 71 1 0 0 0 0 M END