NIH-ZINC00470917 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.7430 1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 -0.9090 1.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3150 -0.4550 1.1450 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6100 -1.5630 2.9330 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9790 -1.7240 3.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1670 -1.9180 4.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3740 -3.0950 3.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.8240 -1.4370 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5250 -2.1160 -1.1610 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 0.0550 -2.3990 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6820 -1.0600 -1.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3600 -2.1930 -1.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6790 -2.3800 -1.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3220 -1.4290 -2.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6390 -0.2940 -3.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3190 -0.1140 -2.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6200 -1.6110 -3.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2180 -0.5910 -3.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 -1.7250 1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -0.1920 2.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 -1.9260 3.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7420 -1.1570 2.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2720 -1.9260 5.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0540 -1.4790 5.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3970 -3.4310 3.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6150 -3.8780 3.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8590 -2.9320 -0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2090 -3.2640 -1.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1380 0.4480 -3.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7850 0.7680 -3.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2520 -0.8600 -4.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6650 -0.4930 -4.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1940 0.3560 -3.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 M END