From 33e09090b73d5df4d3540dc45ef6a73b0d7666cd Mon Sep 17 00:00:00 2001 From: Fawzi Mohamed <fawzi.mohamed@fhi-berlin.mpg.de> Date: Wed, 29 Jun 2016 08:23:46 +0200 Subject: [PATCH] python3 version of generated data --- .../generated_from_data_file.xyz | 640 +++++++++--------- 1 file changed, 320 insertions(+), 320 deletions(-) diff --git a/test/examples/methane_MD_traj/generated_from_data_file.xyz b/test/examples/methane_MD_traj/generated_from_data_file.xyz index 2cff6a5..a09c329 100644 --- a/test/examples/methane_MD_traj/generated_from_data_file.xyz +++ b/test/examples/methane_MD_traj/generated_from_data_file.xyz @@ -1,322 +1,322 @@ 320 -6 -1.14798211506 -7.45097289487 -6.5632019946 -1 -1.49829660536 -7.78265726886 -5.55273350399 -1 -0.0576962060458 -7.39187175095 -6.61048187266 -1 -1.46871282275 8.09872548257 7.11097286491 -1 -1.57866792558 -6.50865546416 -6.84443116282 -6 3.26068655436 -6.47203929727 -5.85620001374 -1 4.08554621937 -6.9993555731 -5.40303755501 -1 2.32099053856 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