ORCA: Get SP tests to print gbasis
ORCA: use coordinates for IR unit test take from basicGAMESS-US2012 (update for 2.9 tests)
ORCA: change expected maximum IR intensity (fixes #41)
Fix typo
Merge pull request #73 from langner/fix_orca

Fix last failing ORCA test by changing expected IR value to near the value in the logfile.