NIH-ZINC04039270 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 63 0 0 1 0 0 0 0 0999 V2000 2.5950 -0.7220 0.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1800 -1.0270 0.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -0.9000 1.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0570 -1.2850 0.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5950 -1.6290 -0.8840 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1390 -1.9370 -1.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7750 -1.4710 -0.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6470 -1.7390 -2.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8470 -1.5660 -1.9640 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1190 -2.1780 -3.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0420 -2.4220 -4.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 -1.3120 0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 -0.4480 2.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 -1.4580 3.6240 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8100 -0.8860 4.8430 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1600 0.1240 4.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1510 -0.8570 5.9460 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3460 -1.3240 5.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3150 -1.4060 6.2920 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3310 -1.7320 4.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2530 -2.1900 3.5010 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1560 -0.3770 7.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 1.1420 7.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2860 3.0810 8.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 3.5260 10.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4110 3.0060 11.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5080 1.5790 11.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8240 1.1140 9.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9780 -1.7700 5.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2590 -1.4810 4.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1590 -2.4480 5.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6080 -3.5220 5.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8580 -3.3440 5.9740 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 0.7380 2.7590 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0500 -1.6180 1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1690 -0.3960 -0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5890 0.0690 1.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5660 -1.4980 -4.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7660 -3.1810 -4.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4880 -2.7700 -5.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9850 -0.3800 0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0070 -2.1500 0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5520 -1.4250 1.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 -0.6310 7.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5190 -0.8480 8.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0360 1.4000 7.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6920 1.6150 6.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0770 3.4280 8.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 3.5040 8.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5890 4.6150 10.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5680 3.1490 10.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3050 1.2590 11.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4380 1.1450 11.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7950 1.5040 9.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 0.0250 9.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5720 -0.5620 4.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2260 -2.3410 5.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1520 -4.3730 6.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 -2.3810 3.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2130 1.6140 8.7210 N 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 13 1 0 0 0 0 4 5 1 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 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 11 38 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 34 2 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 14 59 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 29 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 23 60 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 24 60 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 28 60 1 0 0 0 0 29 30 2 0 0 0 0 29 33 1 0 0 0 0 30 31 1 0 0 0 0 30 56 1 0 0 0 0 31 32 2 0 0 0 0 31 57 1 0 0 0 0 32 33 1 0 0 0 0 32 58 1 0 0 0 0 M END