12 lines
132 B
Plaintext
12 lines
132 B
Plaintext
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#p ROCCSD(T,FreezeInnerNobleGasCore) aug-cc-pVDZ pop=full gfprint
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G2
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0,2
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N
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H,1,RBH
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H,1,RBH,2,HBH
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RBH=1.03128471
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HBH=101.91770685
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