PM7 Accuracy
Date:Mon Feb 11 04:20:05 2019
heptafluoromethane triamine
1638 Heptafluoromethane triamine
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ΔHf: -47.8 kcal/mol, REF: NIST Chemistry WebBook, NIST Standard Reference Database, No. 69; W. G. Mallard, P. J. Linstrom, Eds., National Institute of Standards and Technology, Gaithersberg, http://webbook.nist.gov/chemistry.
PM7
Heptafluoromethane triamine
H=-47.83 HR=NIST
C 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
F 1.34158446 +1 0.0000000 +0 0.0000000 +0 1 0 0
N 1.51652151 +1 105.6844970 +1 0.0000000 +0 1 2 0
N 1.50952321 +1 111.6251337 +1 -115.8254164 +1 1 2 3
N 1.51640924 +1 105.6349278 +1 128.3914131 +1 1 2 3
F 1.37233320 +1 107.3667915 +1 53.4691172 +1 4 1 2
F 1.37230857 +1 107.3753457 +1 -53.1444145 +1 4 1 2
F 1.37177900 +1 107.1949392 +1 -65.5792178 +1 5 1 2
F 1.37074906 +1 107.9624823 +1 -172.9128181 +1 5 1 2
F 1.37076304 +1 107.9144783 +1 171.4479121 +1 3 1 2
F 1.37176446 +1 107.1529149 +1 64.1584903 +1 3 1 2