Rzepa, Henry S. Gaussian Job Archive for C8H14 Archive of work produced using the resources of the Imperial College High Performance Computing Service. InChI=1S/C8H14/c1-2-4-6-8-7-5-3-1/h1-2H,3-8H2/b2-1+;InChIKey=URYYVOIYTNXXBN-OWOJBTEDSA-N;C1C[CH][CH]CCCC1;C8H14;irc(calcfc,recalc=10,maxpoints=150,maxcycle=40);rwb97xd/6-311G(d,p);Organic Chemistry 2012-10-05
    https://figshare.com/articles/dataset/Gaussian_Job_Archive_for_C8H14/96325
10.6084/m9.figshare.96325.v1