13 lines
205 B
Plaintext
13 lines
205 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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0,1
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C
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H,1,RCH
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H,1,RCH,2,109.47122063
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H,1,RCH,2,109.47122063,3,109.47122063,1
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H,1,RCH,2,109.47122063,3,109.47122063,-1
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RCH=1.09185419
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