NIH-ZINC04092875 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 70 0 0 0 0 0 0 0 0999 V2000 0.5180 -4.6830 1.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5160 -3.7650 0.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 -2.3910 0.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -1.5770 -0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -2.0900 -1.3860 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3990 -3.3940 -1.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 -4.2730 -0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 -3.8920 -2.8760 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 -3.0430 -3.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2550 -1.8470 -3.7360 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 -3.5790 -5.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1690 -2.4140 -6.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4110 -2.9500 -7.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5150 -4.1460 -7.8580 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5120 -2.1020 -8.7210 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4990 -0.6550 -8.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9080 -0.1360 -8.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4010 0.1690 -9.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6910 0.6460 -10.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4930 0.8200 -8.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9960 0.5120 -7.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7010 0.0400 -7.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9680 0.7670 -6.7330 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9200 1.6160 -7.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7760 1.2660 -8.7900 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 -2.6260 -10.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0920 -2.8140 -10.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9440 -2.5370 -9.6020 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4490 -3.2900 -11.6290 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8660 -3.4720 -11.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0050 -4.5440 -13.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4850 -4.7340 -13.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0640 -3.4140 -13.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9240 -2.3420 -12.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4450 -2.1520 -12.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 -4.8250 2.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 -5.6460 1.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 -4.2410 2.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7250 -1.9620 1.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7160 -0.5080 -0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3160 -5.3370 -0.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2810 -4.8500 -3.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7450 -4.2340 -5.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0110 -4.1410 -5.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9920 -1.7590 -6.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7650 -1.8520 -6.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1460 -0.1660 -9.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8590 -0.4430 -7.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 0.0340 -10.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0740 0.8830 -11.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3110 -0.1940 -6.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6730 2.6660 -7.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9320 1.4030 -7.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1880 -1.9230 -10.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1210 -3.5850 -10.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7680 -3.5110 -12.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4070 -3.7850 -11.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4640 -4.2310 -13.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5930 -5.4840 -12.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5840 -5.4970 -14.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0260 -5.0470 -12.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5230 -3.1010 -14.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1180 -3.5490 -14.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3370 -1.4010 -13.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4660 -2.6550 -11.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3460 -1.3880 -11.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9040 -1.8390 -13.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 42 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 12 45 1 0 0 0 0 12 46 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 26 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 22 2 0 0 0 0 18 19 2 0 0 0 0 18 49 1 0 0 0 0 19 20 1 0 0 0 0 19 50 1 0 0 0 0 20 21 2 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 26 27 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 56 1 0 0 0 0 30 31 1 0 0 0 0 30 35 1 0 0 0 0 30 57 1 0 0 0 0 31 32 1 0 0 0 0 31 58 1 0 0 0 0 31 59 1 0 0 0 0 32 33 1 0 0 0 0 32 60 1 0 0 0 0 32 61 1 0 0 0 0 33 34 1 0 0 0 0 33 62 1 0 0 0 0 33 63 1 0 0 0 0 34 35 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 M END