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quantum_package/src/MRCC/README.rst
2015-04-02 10:13:33 +02:00

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-4.142795384334731
4.695183071437694E-002
Determinant 64
---------------------------------------------
000000000000002E|000000000000002E
|-+++-+----------------------------------------------------------|
|-+++-+----------------------------------------------------------|
CAS-SD: -4.14214374069306
: -4.14230904320551
E0 = -11.5634986758976