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EmieeelEmieeel
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qub files and OO optimized stuff
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Diff for: ‎CUBE_FILES/pyscfcubeCMOhnc3h6_s0min_dzpsto-3gBoys0000

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Orbital value in real space (1/Bohr^3)
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PySCF Version: 1.7.1 Date: Fri Jan 22 15:51:32 2021
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PySCF Version: 1.7.1 Date: Wed Jan 27 10:13:06 2021
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11 -3.958989 -7.840022 -4.917645
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80 0.164551 0.000000 0.000000
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Diff for: ‎CUBE_FILES/pyscfcubeCMOhnc3h6_s0min_dzpsto-3gBoys0001

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Orbital value in real space (1/Bohr^3)
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PySCF Version: 1.7.1 Date: Fri Jan 22 15:51:32 2021
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PySCF Version: 1.7.1 Date: Wed Jan 27 10:13:07 2021
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11 -3.958989 -7.840022 -4.917645
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80 0.164551 0.000000 0.000000
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80 0.000000 0.153958 0.000000

Diff for: ‎CUBE_FILES/pyscfcubeCMOhnc3h6_s0min_dzpsto-3gBoys00010

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Orbital value in real space (1/Bohr^3)
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PySCF Version: 1.7.1 Date: Fri Jan 22 15:51:35 2021
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PySCF Version: 1.7.1 Date: Wed Jan 27 10:13:10 2021
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11 -3.958989 -7.840022 -4.917645
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80 0.164551 0.000000 0.000000
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80 0.000000 0.153958 0.000000

Diff for: ‎CUBE_FILES/pyscfcubeCMOhnc3h6_s0min_dzpsto-3gBoys00011

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Orbital value in real space (1/Bohr^3)
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PySCF Version: 1.7.1 Date: Fri Jan 22 15:51:36 2021
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PySCF Version: 1.7.1 Date: Wed Jan 27 10:13:10 2021
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11 -3.958989 -7.840022 -4.917645
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80 0.164551 0.000000 0.000000
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80 0.000000 0.153958 0.000000

Diff for: ‎CUBE_FILES/pyscfcubeCMOhnc3h6_s0min_dzpsto-3gBoys00012

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Orbital value in real space (1/Bohr^3)
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PySCF Version: 1.7.1 Date: Fri Jan 22 15:51:36 2021
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PySCF Version: 1.7.1 Date: Wed Jan 27 10:13:10 2021
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11 -3.958989 -7.840022 -4.917645
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80 0.164551 0.000000 0.000000
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80 0.000000 0.153958 0.000000

Diff for: ‎CUBE_FILES/pyscfcubeCMOhnc3h6_s0min_dzpsto-3gBoys00013

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Orbital value in real space (1/Bohr^3)
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PySCF Version: 1.7.1 Date: Fri Jan 22 15:51:37 2021
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PySCF Version: 1.7.1 Date: Wed Jan 27 10:13:11 2021
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11 -3.958989 -7.840022 -4.917645
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80 0.164551 0.000000 0.000000
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80 0.000000 0.153958 0.000000

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