Function to read/return ORCA single point energy#25
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mefuller wants to merge 1 commit intomolmod:masterfrom
mefuller:mefuller-SinglePointEnergies
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Function to read/return ORCA single point energy#25mefuller wants to merge 1 commit intomolmod:masterfrom mefuller:mefuller-SinglePointEnergies
mefuller wants to merge 1 commit intomolmod:masterfrom
mefuller:mefuller-SinglePointEnergies
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Also includes unit test with example ORCA output file for testing
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Also includes unit test with example ORCA output file for testing