NIH-ZINC00420414 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 33 0 0 0 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 1.2160 -0.6630 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3500 0.0090 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3740 1.3320 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1910 2.0600 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6000 2.0030 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8030 3.3580 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0910 3.5570 -0.0260 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7130 2.4330 -0.0380 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8500 1.4440 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2270 -0.2780 -0.0340 S 0 0 0 0 0 0 0 0 0 0 0 0 7.0360 -0.2020 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5970 -1.6010 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8460 -2.2410 -1.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3600 -3.5240 -1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6260 -4.1670 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3770 -3.5260 1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8670 -2.2410 1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2720 -5.7790 -0.0660 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9520 1.9240 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9220 -0.5620 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 -1.7430 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 3.1400 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0380 4.1200 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3720 0.3270 -0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3830 0.3260 0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6380 -1.7390 -2.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5550 -4.0240 -2.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5840 -4.0280 2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6770 -1.7390 2.0810 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 21 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 8 25 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 28 1 0 0 0 0 16 17 1 0 0 0 0 16 29 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 30 1 0 0 0 0 19 31 1 0 0 0 0 M END