NIH-ZINC05686226 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 1 0 0 0 0 0999 V2000 -0.6340 1.5580 0.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0500 0.1540 0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6000 -0.1830 -1.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2970 -1.5510 -1.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9370 -1.9500 -2.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9100 -1.9430 -3.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2190 -0.5840 -3.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4140 -0.1710 -2.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 -2.5740 -6.0240 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1700 -1.6860 -6.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6680 -2.6970 -7.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 -3.7100 -7.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3500 -5.1630 -7.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6660 -5.5160 -5.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3080 -5.0210 -5.7660 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1620 -3.7440 -5.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3640 -3.5390 -5.6290 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1150 2.3090 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4930 1.6690 -0.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9790 1.7730 1.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7040 0.0620 0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8390 -0.5730 0.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3680 0.5750 -1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0700 -1.5280 -0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 -2.3210 -0.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7580 -1.2570 -2.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 -2.9470 -2.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1810 -2.7440 -3.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9390 0.1850 -3.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5670 -0.6080 -4.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2460 -0.8490 -2.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8440 0.8300 -2.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 -2.9250 -8.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1080 -1.7120 -7.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3960 -3.5880 -8.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4970 -3.4910 -6.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6940 -5.3910 -8.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2380 -5.7990 -7.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5990 -6.6060 -5.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2320 -5.1530 -4.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4250 -5.7110 -5.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6470 -2.2600 -4.8080 N 0 3 0 0 0 0 0 0 0 0 0 0 2.2730 -1.4740 -5.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2640 -3.0600 -4.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 21 1 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 16 1 0 0 0 0 9 42 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 2 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 M CHG 1 42 1 M END