1# This is a comment
2! This is a comment as well
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4# Coordinates are given in the file
5System ../h2o-dimer.xyz
6# Use LDA exchange and VWN correlation
7Method lda_x-lda_c_vwn
8# Use the cc-pVDZ basis set
9Basis cc-pVDZ
10# Save the results in the checkpoint file
11SaveChk lda.chk
12# Use the core guess to initialize the calculation
13Guess Core
14