NIH-ZINC03959167 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 65 0 0 0 0 0 0 0 0999 V2000 0.1130 1.4790 0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -0.0380 0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 -0.4980 -1.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1280 -0.6930 -1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9990 -0.4360 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3760 -0.6380 -0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9060 -1.0980 -1.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0590 -1.3530 -2.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6700 -1.1540 -2.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7810 -1.4170 -3.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4670 -1.2080 -3.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 -0.7250 -2.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3510 -0.5490 -2.0830 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4200 -1.8640 -4.6230 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6310 -2.1080 -5.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5060 -2.5490 -6.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7300 -2.6380 -6.8420 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8500 -2.8340 -8.1500 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6360 -3.2890 -9.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3700 -2.4270 -10.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 -1.8660 -9.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4050 -2.7340 -8.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5730 -1.6050 -12.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8410 -1.7800 -12.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7360 -0.6830 -12.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0590 -0.8380 -13.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4610 -2.0930 -13.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5990 -3.1620 -13.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2870 -3.0410 -13.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1910 -4.3110 -13.8430 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5270 -3.8410 -14.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7040 -2.4320 -13.8640 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1320 1.8770 0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4270 1.9410 -0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3700 1.7890 1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5830 -0.5140 1.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9410 -0.3750 0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6400 -0.0670 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0320 -0.4320 0.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9770 -1.2560 -1.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4980 -1.7110 -3.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2460 -1.3770 -4.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9140 -2.9100 -5.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1220 -1.1840 -6.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7080 -3.2850 -9.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3480 -4.3290 -9.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7010 -1.3940 -10.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8600 -2.8540 -11.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 -1.9110 -9.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4050 -0.8260 -9.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -3.7540 -8.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1230 -2.3290 -7.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 -1.9660 -12.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8100 -0.5540 -11.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4070 0.3030 -12.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7490 -0.0010 -13.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 -3.9080 -13.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7550 -4.0370 -15.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2330 -4.4020 -13.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8730 -2.3820 -10.8250 N 0 3 0 0 0 0 0 0 0 0 0 0 0.5680 -3.3490 -10.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 12 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 38 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 2 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 12 13 2 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 20 60 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 21 60 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 23 53 1 0 0 0 0 23 54 1 0 0 0 0 23 60 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 26 56 1 0 0 0 0 27 28 2 0 0 0 0 27 32 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 29 57 1 0 0 0 0 30 31 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 60 61 1 0 0 0 0 M CHG 1 60 1 M END