PM7 Accuracy
Date:Mon Feb 11 04:20:05 2019
carbon, tetramer
104 Carbon, tetramer
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ΔHf: 232.0 kcal/mol, REF: M. W. Chase, C. A. Davies, J. R. Downey, D. R. Frurip, R. A. McDonald, A. N. Syverud, JANAF Thermochemical Tables, Third Edition, J. Phys. Chem. Ref. Data 14, Suppl. 1 (1985).
UHF TRIPLET PM7
Carbon, tetramer
H=232.0 HR=JANAF86
C 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
C 1.30710203 +1 0.0000000 +0 0.0000000 +0 1 0 0
C 1.27946150 +1 179.9997851 +1 180.0000000 +0 2 1 0
C 1.30710194 +1 179.9997488 +1 -170.0000000 +1 3 2 1