NIH-ZINC02938809 MOE2007 3D CORINA 3.40 0006 02.08.2006 63 66 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -4.5300 -0.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -4.9170 -1.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -4.9300 1.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -5.0430 -0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3840 -4.7540 -1.1490 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7800 -4.6160 -2.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3500 -5.9220 -1.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5740 -7.1510 -1.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3670 -7.0980 -1.8580 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2210 -8.3090 -1.9940 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4780 -9.5160 -2.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8520 -10.6530 -1.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3720 -10.8240 -1.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0370 -9.5360 -0.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6820 -8.3900 -1.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8340 -11.1310 -2.7330 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4940 -12.4120 -2.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8580 -12.5440 -1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7240 -11.9060 -0.5340 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1690 -3.4970 -0.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3800 -2.5800 -1.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0990 -1.4270 -1.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6080 -1.1890 -0.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3940 -2.1100 0.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6800 -3.2640 0.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3150 -0.0540 -0.1220 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8090 0.1240 1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8540 -5.5350 0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8930 -6.1160 -0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0580 -5.6690 -2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7390 -9.7950 -3.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4070 -9.3220 -2.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3850 -11.5790 -1.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5050 -10.4130 -0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1190 -9.6700 -0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6800 -9.3000 0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0670 -7.4530 -1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1240 -8.5770 -2.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3930 -12.4140 -3.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8160 -13.2100 -2.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7820 -12.0120 -0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9300 -13.5910 -0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9840 -2.7660 -2.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2640 -0.7110 -2.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7890 -1.9270 1.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5170 -3.9840 1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3530 1.0670 1.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4770 -0.6980 1.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9730 0.1420 1.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 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 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 7 41 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 27 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 20 26 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 55 1 0 0 0 0 25 56 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 57 1 0 0 0 0 29 30 1 0 0 0 0 29 58 1 0 0 0 0 30 31 2 0 0 0 0 30 33 1 0 0 0 0 31 32 1 0 0 0 0 31 59 1 0 0 0 0 32 60 1 0 0 0 0 33 34 1 0 0 0 0 34 61 1 0 0 0 0 34 62 1 0 0 0 0 34 63 1 0 0 0 0 M END