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__init__.py
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__init__.py
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from .psi4_read import psi4_read_hessian
from .psi4_read import psi4_read_dipole_derivatives
from .psi4_read import psi4_read_polarizabilities
from .psi4_read import psi4_read_optical_rotation_tensor
from .psi4_read import psi4_read_dipole_quadrupole_polarizability
from .psi4_read import psi4_read_ZMAT
from .scatter import scatter
from .scatter import omega_in_au
from .spectrum import SPECTRUM
#from .old-compare import compareOutputFiles, compareSpectraFiles, reorder
from .mode_scatter import modeVectorsQCDB, modeScatter
from sys import platform
from .plot import discretizedSpectrum, computeSquaredArea, computeProductArea
from .plot import plotPeaks, plotSpectra, plotROAspectrum, compareBroadenedSpectra
from . import Psi4ROA
from . import cfour
#try:
# import matplotlib
# if platform != 'darwin':
# matplotlib.use('TkAgg')
# from .plot import plotSpectrum, plotROAspectrum
#except ImportError:
# pass