NIH-ZINC01335358 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3840 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 1.1860 -0.6850 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 0.0190 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3750 1.4240 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 2.0980 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6970 1.8220 -0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0220 2.7360 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4590 0.6950 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6980 -0.3600 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9660 0.6730 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4640 0.7980 -1.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9950 0.7400 -1.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5160 1.7690 -0.5950 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0330 1.7950 0.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5010 1.8410 0.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4200 2.6720 -1.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8110 2.6390 -2.1720 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9440 3.7210 -0.0780 C 0 0 3 0 0 0 0 0 0 0 0 0 10.3720 3.2520 0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8160 4.6970 0.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5180 6.0720 0.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9880 5.7630 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9310 4.5440 -0.7380 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9070 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.5510 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1900 -1.7650 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 3.1780 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3190 -0.2670 0.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0640 -0.0220 -2.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1330 1.7480 -1.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3260 -0.2440 -1.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3590 0.9270 -2.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3670 0.8970 1.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4210 2.6790 1.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1690 2.7820 0.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1270 1.7640 1.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0350 4.7100 -0.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4010 4.4250 1.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0840 6.7630 -0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4510 6.4790 1.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4100 6.5720 -0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5770 5.6090 0.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 9 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 16 1 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 24 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 M END