Author: bugman Date: Fri Jun 17 11:17:27 2011 New Revision: 13089 URL: http://svn.gna.org/viewcvs/relax?rev=13089&view=rev Log: Modifying test_suite/shared_data/structures/Indol_test.xyz This is Han's patch https://gna.org/task/download.php?file_id=13245 attached to the task http://gna.org/task/?7404. In the test_suite/shared_data/structures/Indol_test.xyz 0.00000 after the molecule name was removed. The reason for that is because in a typical xyz file the second line is just the molecule name. Modified: branches/xyz/test_suite/shared_data/structures/Indol_test.xyz Modified: branches/xyz/test_suite/shared_data/structures/Indol_test.xyz URL: http://svn.gna.org/viewcvs/relax/branches/xyz/test_suite/shared_data/structures/Indol_test.xyz?rev=13089&r1=13088&r2=13089&view=diff ============================================================================== --- branches/xyz/test_suite/shared_data/structures/Indol_test.xyz (original) +++ branches/xyz/test_suite/shared_data/structures/Indol_test.xyz Fri Jun 17 11:17:27 2011 @@ -1,5 +1,5 @@ 16 -1-Indolizinyl 0.000000 +1-Indolizinyl C 0.0784 1.9475 -0.3681 H -0.3810 2.9138 -0.3681 C 1.4607 1.6737 -0.3682