name: obabel channels: - conda-forge - defaults dependencies: - annotated-types=0.7.0=pyhd8ed1ab_0 - appdirs=1.4.4=pyh9f0ad1d_0 - astroid=3.2.4=py312h2e8e312_0 - asttokens=2.4.1=pyhd8ed1ab_0 - attrs=24.2.0=pyh71513ae_0 - aws-c-auth=0.7.25=h7db803d_6 - aws-c-cal=0.7.3=ha1e9ad3_2 - aws-c-common=0.9.27=h2466b09_0 - aws-c-compression=0.2.19=ha1e9ad3_0 - aws-c-event-stream=0.4.3=hf2a634e_0 - aws-c-http=0.8.7=h7d4ba70_5 - aws-c-io=0.14.18=h8d4122e_6 - aws-c-mqtt=0.10.4=h827f298_17 - aws-c-s3=0.6.4=h21392f2_8 - aws-c-sdkutils=0.1.19=ha1e9ad3_2 - aws-checksums=0.1.18=ha1e9ad3_10 - aws-crt-cpp=0.27.6=h6fef074_0 - aws-sdk-cpp=1.11.379=hd66f94a_5 - brotli=1.1.0=hcfcfb64_1 - brotli-bin=1.1.0=hcfcfb64_1 - bzip2=1.0.8=h2466b09_7 - c-ares=1.33.0=h2466b09_0 - ca-certificates=2024.7.4=h56e8100_0 - cairo=1.18.0=h32b962e_3 - certifi=2024.7.4=pyhd8ed1ab_0 - chardet=5.2.0=py312h2e8e312_1 - colorama=0.4.6=pyhd8ed1ab_0 - comm=0.2.2=pyhd8ed1ab_0 - contourpy=1.2.1=py312h0d7def4_0 - cycler=0.12.1=pyhd8ed1ab_0 - debugpy=1.8.5=py312h275cf98_0 - decorator=5.1.1=pyhd8ed1ab_0 - dill=0.3.8=pyhd8ed1ab_0 - dkh=1.2=h6fe31a0_1 - exceptiongroup=1.2.2=pyhd8ed1ab_0 - executing=2.0.1=pyhd8ed1ab_0 - expat=2.6.2=h63175ca_0 - flake8=7.1.1=pyhd8ed1ab_0 - flexcache=0.3=pyhd8ed1ab_0 - flexparser=0.3.1=pyhd8ed1ab_0 - font-ttf-dejavu-sans-mono=2.37=hab24e00_0 - font-ttf-inconsolata=3.000=h77eed37_0 - font-ttf-source-code-pro=2.038=h77eed37_0 - font-ttf-ubuntu=0.83=h77eed37_2 - fontconfig=2.14.2=hbde0cde_0 - fonts-conda-ecosystem=1=0 - fonts-conda-forge=1=0 - fonttools=4.53.1=py312h4389bb4_0 - freetype=2.12.1=hdaf720e_2 - freetype-py=2.3.0=pyhd8ed1ab_0 - gau2grid=2.0.7=h2466b09_4 - greenlet=3.0.3=py312h53d5487_0 - icu=75.1=he0c23c2_0 - importlib-metadata=8.4.0=pyha770c72_0 - importlib_metadata=8.4.0=hd8ed1ab_0 - importlib_resources=6.4.4=pyhd8ed1ab_0 - intel-openmp=2023.2.0=h57928b3_50497 - ipykernel=6.29.5=pyh4bbf305_0 - ipython=8.26.0=pyh7428d3b_0 - isort=5.13.2=pyhd8ed1ab_0 - jedi=0.19.1=pyhd8ed1ab_0 - jsonschema=4.23.0=pyhd8ed1ab_0 - jsonschema-specifications=2023.12.1=pyhd8ed1ab_0 - jupyter_client=8.6.2=pyhd8ed1ab_0 - jupyter_core=5.7.2=py312h2e8e312_0 - kaleido-core=0.2.1=h8ffe710_0 - kiwisolver=1.4.5=py312h0d7def4_1 - krb5=1.21.3=hdf4eb48_0 - lcms2=2.16=h67d730c_0 - lerc=4.0.0=h63175ca_0 - libabseil=20240116.2=cxx17_he0c23c2_1 - libarrow=17.0.0=hd7a7e94_9_cpu - libarrow-acero=17.0.0=he0c23c2_9_cpu - libarrow-dataset=17.0.0=he0c23c2_9_cpu - libarrow-substrait=17.0.0=h1f0e801_9_cpu - libblas=3.9.0=20_win64_mkl - libboost=1.84.0=h444863b_5 - libboost-python=1.84.0=py312hbaa7e33_5 - libbrotlicommon=1.1.0=hcfcfb64_1 - libbrotlidec=1.1.0=hcfcfb64_1 - libbrotlienc=1.1.0=hcfcfb64_1 - libcblas=3.9.0=20_win64_mkl - libcrc32c=1.1.2=h0e60522_0 - libcurl=8.9.1=h18fefc2_0 - libdeflate=1.21=h2466b09_0 - libecpint=1.0.7=h372dad0_11 - libevent=2.1.12=h3671451_1 - libexpat=2.6.2=h63175ca_0 - libffi=3.4.2=h8ffe710_5 - libglib=2.80.3=h7025463_2 - libgoogle-cloud=2.28.0=h5e7cea3_0 - libgoogle-cloud-storage=2.28.0=he5eb982_0 - libgrpc=1.62.2=h5273850_0 - libhwloc=2.11.1=default_h8125262_1000 - libiconv=1.17=hcfcfb64_2 - libint=2.9.0=h63175ca_0 - libintl=0.22.5=h5728263_3 - libjpeg-turbo=3.0.0=hcfcfb64_1 - liblapack=3.9.0=20_win64_mkl - libparquet=17.0.0=ha915800_9_cpu - libpcm=1.2.3=h52e9898_12 - libpng=1.6.43=h19919ed_0 - libpq=16.4=hab9416b_0 - libprotobuf=4.25.3=h503648d_0 - librdkit=2024.03.5=h4c5bbc8_3 - libre2-11=2023.09.01=hf8d8778_2 - libsodium=1.0.18=h8d14728_1 - libsqlite=3.46.0=h2466b09_0 - libssh2=1.11.0=h7dfc565_0 - libthrift=0.20.0=ha2b3283_0 - libtiff=4.6.0=hb151862_4 - libutf8proc=2.8.0=h82a8f57_0 - libwebp-base=1.4.0=hcfcfb64_0 - libxc-c=6.2.2=cpu_hc9d4dcb_5 - libxcb=1.16=h013a479_1 - libxml2=2.12.7=h0f24e4e_4 - libzlib=1.3.1=h2466b09_1 - lz4-c=1.9.4=hcfcfb64_0 - m2w64-gcc-libgfortran=5.3.0=6 - m2w64-gcc-libs=5.3.0=7 - m2w64-gcc-libs-core=5.3.0=7 - m2w64-gmp=6.1.0=2 - m2w64-libwinpthread-git=5.0.0.4634.697f757=2 - mathjax=2.7.7=h57928b3_3 - matplotlib-base=3.9.2=py312h90004f6_0 - matplotlib-inline=0.1.7=pyhd8ed1ab_0 - mccabe=0.7.0=pyhd8ed1ab_0 - mkl=2023.2.0=h6a75c08_50497 - msgpack-python=1.0.8=py312hd5eb7cc_0 - msys2-conda-epoch=20160418=1 - munkres=1.1.4=pyh9f0ad1d_0 - nbformat=5.10.4=pyhd8ed1ab_0 - nest-asyncio=1.6.0=pyhd8ed1ab_0 - networkx=3.3=pyhd8ed1ab_1 - numpy=2.1.0=py312h49bc9c5_0 - openbabel=3.1.1=py312hebe574a_9 - openjpeg=2.5.2=h3d672ee_0 - openssl=3.3.1=h2466b09_3 - optking=0.2.1=pyhd8ed1ab_0 - orc=2.0.2=h784c2ca_0 - packaging=24.1=pyhd8ed1ab_0 - pandas=2.2.2=py312h72972c8_1 - parso=0.8.4=pyhd8ed1ab_0 - patsy=0.5.6=pyhd8ed1ab_0 - pcmsolver=1.2.3=py_12 - pcre2=10.44=h3d7b363_2 - pickleshare=0.7.5=py_1003 - pillow=10.4.0=py312h381445a_0 - pint=0.24.3=pyhd8ed1ab_0 - pip=24.2=pyhd8ed1ab_0 - pixman=0.43.4=h63175ca_0 - pkgutil-resolve-name=1.3.10=pyhd8ed1ab_1 - platformdirs=4.2.2=pyhd8ed1ab_0 - plotly=5.23.0=pyhd8ed1ab_0 - plotly_express=0.4.1=py_0 - prompt-toolkit=3.0.47=pyha770c72_0 - psi4=1.9.1=py312h58fe6e1_1 - psutil=6.0.0=py312h4389bb4_0 - pthread-stubs=0.4=hcd874cb_1001 - pthreads-win32=2.9.1=hfa6e2cd_3 - pugixml=1.14=h63175ca_0 - pure_eval=0.2.3=pyhd8ed1ab_0 - py-cpuinfo=9.0.0=pyhd8ed1ab_0 - py3dmol=2.3.0=pyhd8ed1ab_0 - pyarrow=17.0.0=py312h7e22eef_1 - pyarrow-core=17.0.0=py312h6a9c419_1_cpu - pybind11-abi=4=hd8ed1ab_3 - pycairo=1.26.1=py312h487989a_0 - pycodestyle=2.12.1=pyhd8ed1ab_0 - pydantic=2.8.2=pyhd8ed1ab_0 - pydantic-core=2.20.1=py312h2615798_0 - pyflakes=3.2.0=pyhd8ed1ab_0 - pygments=2.18.0=pyhd8ed1ab_0 - pylint=3.2.6=pyhd8ed1ab_0 - pyparsing=3.1.2=pyhd8ed1ab_0 - python=3.12.5=h889d299_0_cpython - python-dateutil=2.9.0=pyhd8ed1ab_0 - python-fastjsonschema=2.20.0=pyhd8ed1ab_0 - python-kaleido=0.2.1=pyhd8ed1ab_0 - python-tzdata=2024.1=pyhd8ed1ab_0 - python_abi=3.12=5_cp312 - pytz=2024.1=pyhd8ed1ab_0 - pywin32=306=py312h53d5487_2 - pyyaml=6.0.2=py312h4389bb4_0 - pyzmq=26.2.0=py312hd7027bb_0 - qcelemental=0.28.0=pyhd8ed1ab_0 - qcengine=0.30.0=pyhd8ed1ab_0 - qhull=2020.2=hc790b64_5 - rdkit=2024.03.5=py312h9d9823f_3 - re2=2023.09.01=hd3b24a8_2 - referencing=0.35.1=pyhd8ed1ab_0 - reportlab=4.2.2=py312h4389bb4_0 - rlpycairo=0.2.0=pyhd8ed1ab_0 - rpds-py=0.20.0=py312h2615798_0 - scipy=1.14.1=py312h1f4e10d_0 - setuptools=72.2.0=pyhd8ed1ab_0 - six=1.16.0=pyh6c4a22f_0 - snappy=1.2.1=h23299a8_0 - sqlalchemy=2.0.32=py312h4389bb4_0 - stack_data=0.6.2=pyhd8ed1ab_0 - statsmodels=0.14.2=py312h1a27103_0 - tbb=2021.12.0=hc790b64_3 - tenacity=9.0.0=pyhd8ed1ab_0 - tk=8.6.13=h5226925_1 - tomli=2.0.1=pyhd8ed1ab_0 - tomlkit=0.13.2=pyha770c72_0 - tornado=6.4.1=py312h4389bb4_0 - traitlets=5.14.3=pyhd8ed1ab_0 - typing-extensions=4.12.2=hd8ed1ab_0 - typing_extensions=4.12.2=pyha770c72_0 - tzdata=2024a=h0c530f3_0 - ucrt=10.0.22621.0=h57928b3_0 - vc=14.3=h8a93ad2_20 - vc14_runtime=14.40.33810=ha82c5b3_20 - vs2015_runtime=14.40.33810=h3bf8584_20 - wcwidth=0.2.13=pyhd8ed1ab_0 - wheel=0.44.0=pyhd8ed1ab_0 - xlsxwriter=3.2.0=pyhd8ed1ab_0 - xorg-libxau=1.0.11=hcd874cb_0 - xorg-libxdmcp=1.1.3=hcd874cb_0 - xz=5.2.6=h8d14728_0 - yaml=0.2.5=h8ffe710_2 - zeromq=4.3.5=he1f189c_4 - zipp=3.20.0=pyhd8ed1ab_0 - zlib=1.3.1=h2466b09_1 - zstd=1.5.6=h0ea2cb4_0 prefix: C:\Users\venkata.ramaswamy\miniconda3\envs\obabel