Moved package one level deeper, can't use mainFunction anymore so next creating my own...

parser/parser-cp2k/cp2karser.egg-info/PKG-INFO

+Metadata-Version: 1.0
+Name: cp2karser
+Version: 0.1
+Summary: NoMaD parser implementation for CP2K
+Home-page: UNKNOWN
+Author: Lauri Himanen
+Author-email: lauri.himanen@gmail.com
+License: GPL3
+Description: UNKNOWN
+Platform: UNKNOWN

parser/parser-cp2k/cp2karser.egg-info/SOURCES.txt

+setup.py
+cp2karser.egg-info/PKG-INFO
+cp2karser.egg-info/SOURCES.txt
+cp2karser.egg-info/dependency_links.txt
+cp2karser.egg-info/not-zip-safe
+cp2karser.egg-info/requires.txt
+cp2karser.egg-info/top_level.txt
+cp2kparser/__init__.py
+cp2kparser/__main__.py
+cp2kparser/scalainterface.py
\ No newline at end of file

parser/parser-cp2k/cp2karser.egg-info/dependency_links.txt

+

parser/parser-cp2k/cp2karser.egg-info/not-zip-safe

+

parser/parser-cp2k/cp2karser.egg-info/requires.txt

+pint
+numpy
+ase
\ No newline at end of file

parser/parser-cp2k/cp2karser.egg-info/top_level.txt

+cp2kparser

parser/parser-cp2k/cp2kparser/__init__.py

+import cp2kparser.utils.logconfig
+from cp2kparser.parsing.parser import CP2KParser

parser/parsercp2k/parsing/implementations.py → parser/parser-cp2k/cp2kparser/parsing/implementations.py

 import re
 import os
 import logging
-from parsercp2k.parsing.csvparsing import CSVParser
-from parsercp2k.parsing.inputparsing import CP2KInputParser
-from parsercp2k.parsing.cp2kinputenginedata.input_tree import CP2KInput
-from parsercp2k.parsing.outputparsing import *
-from parsercp2k.utils.baseclasses import ParserImplementation
+from cp2kparser.parsing.csvparsing import CSVParser
+from cp2kparser.parsing.inputparsing import CP2KInputParser
+from cp2kparser.parsing.cp2kinputenginedata.input_tree import CP2KInput
+from cp2kparser.parsing.outputparsing import *
+from cp2kparser.utils.baseclasses import ParserImplementation
 from nomadcore.coordinate_reader import CoordinateReader
 logger = logging.getLogger(__name__)
 

parser/parsercp2k/parsing/outputparsing.py → parser/parser-cp2k/cp2kparser/parsing/outputparsing.py

@@ -204,7 +204,7 @@ class CP2KOutputParser262(object):
             cell[1, :] = b_comp
             cell[2, :] = c_comp
 
-            backend.addArrayValues("cell", cell, unit="angstrom")
+            backend.addArrayValues("simulation_cell", cell, unit="angstrom")
 
         # Get the number of atoms
         numbers = section["cp2k_section_numbers"]