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uid 393
scaling factor multiple (3)

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This species has a counterpart in the experimental library



Number of atoms 32
Weight 252.0939 amu
Total energy -768.3986 Hartree
Zero-point energy 161.1137 Kcal/mol
Scaling factor multiple (3)
Method RB3LYP
State 1-A1
Solo hydrogens 2
Duo hydrogens 0
Trio hydrogens 6
Quartet hydrogens 4
Quintet hydrogens 0
CH2 0
CHx 0




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4,233 species present in version 3.20 of the theoretical database (Sep 12, 2019)