<commit_before># Data sources
database(
    thermoLibraries = ['primaryThermoLibrary'],
    reactionLibraries = [],
    seedMechanisms = [],
    kineticsDepositories = ['training'],
    kineticsFamilies = ['!Intra_Disproportionation','!Substitution_O'],
    kineticsEstimator = 'rate rules',
)

# List of species
species(
    label='ethane',
    reactive=True,
    structure=SMILES("CC"),<commit_msg>Update RMG example minimal_sensitivity with multiplicity label<commit_after># Data sources
database(
    thermoLibraries = ['primaryThermoLibrary'],
    reactionLibraries = [],
    seedMechanisms = [],
    kineticsDepositories = ['training'],
    kineticsFamilies = ['!Intra_Disproportionation','!Substitution_O'],
    kineticsEstimator = 'rate rules',
)

# Constraints on generated species
generatedSpeciesConstraints(
    maximumRadicalElectrons = 2,
)

# List of species
species(
    label='ethane',
    multiplicity = 1,
    reactive=True,
    structure=SMILES("CC"),
{'fraction_non_alphanumeric': 0.12049433573635428, 'fraction_numerical': 0.0020597322348094747, 'mean_word_length': 4.890909090909091, 'pattern_counts': {'":': 0, '<': 3, '<?xml version=': 0, '>': 3, 'https://': 0, 'lorem ipsum': 0, 'www.': 0, 'xml': 0}, 'pii_count': 0, 'substrings_counts': 0, 'word_list_counts': {'cursed_substrings.json': 0, 'profanity_word_list.json': 0, 'sexual_word_list.json': 0, 'zh_pornsignals.json': 0}}
{'dir': 'git-commits-cleaned', 'id': '356600', 'n_tokens_mistral': 311, 'n_tokens_neox': 281, 'n_words': 58}