PM7 Accuracy
Date:Mon Feb 11 04:20:05 2019
vanadium(v) tri-ethoxide oxide
3038 Vanadium(V) tri-ethoxide oxide
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ΔHf: -242.5 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
Vanadium(V) tri-ethoxide oxide
H=-242.5 HR=NIST
O 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
V 1.56830386 +1 0.0000000 +0 0.0000000 +0 1 0 0
O 1.76936756 +1 113.0464651 +1 0.0000000 +0 2 1 0
O 1.76936610 +1 113.0299074 +1 120.1235354 +1 2 1 3
O 1.76946765 +1 112.9777754 +1 -119.9344831 +1 2 1 3
C 1.38113146 +1 178.5957883 +1 -1.7144275 +1 5 2 1
C 1.53081879 +1 108.9139588 +1 1.0509562 +1 6 5 2
C 1.38119202 +1 178.6113966 +1 -0.9266080 +1 4 2 1
C 1.53085154 +1 108.9062296 +1 1.4360802 +1 8 4 2
C 1.38120648 +1 178.6080793 +1 -2.2276166 +1 3 2 1
C 1.53085923 +1 108.9049265 +1 0.7397497 +1 10 3 2
H 1.10922968 +1 107.2426971 +1 122.2312993 +1 6 5 2
H 1.10921912 +1 107.2461207 +1 -120.1286229 +1 6 5 2
H 1.09274780 +1 111.5625543 +1 179.8086029 +1 7 6 5
H 1.09791902 +1 110.7728363 +1 58.7705357 +1 7 6 5
H 1.09784347 +1 110.7852723 +1 -59.1403038 +1 7 6 5
H 1.10921690 +1 107.2357641 +1 122.5978851 +1 8 4 2
H 1.10921891 +1 107.2497129 +1 -119.7613906 +1 8 4 2
H 1.09276406 +1 111.5614520 +1 179.8178630 +1 9 8 4
H 1.09786794 +1 110.7664249 +1 58.7888068 +1 9 8 4
H 1.09788276 +1 110.7869582 +1 -59.1199739 +1 9 8 4
H 1.10922138 +1 107.2408707 +1 121.9229706 +1 10 3 2
H 1.10921026 +1 107.2428047 +1 -120.4382697 +1 10 3 2
H 1.09277516 +1 111.5591205 +1 179.5243981 +1 11 10 3
H 1.09796866 +1 110.7648421 +1 58.4938348 +1 11 10 3
H 1.09777500 +1 110.7878524 +1 -59.4160818 +1 11 10 3