 43
 Energy -1222.49485184
 C   -1.81802962  -1.15389470   0.30418250   161.51
 C   -1.76254815  -2.43277055  -0.27425293   108.76
 C   -0.50135123  -3.02509650  -0.48668464   169.74
 C    0.74075757  -2.36452335  -0.14707694   101.41
 C    0.60442561  -1.10220445   0.46620059   161.50
 C   -0.62928248  -0.52369370   0.73369467   101.44
 O    1.65542063  -0.32508916   0.86640584
 C    1.11411565   0.74106196   1.70675073    90.48
 C   -0.41579381   0.81168564   1.43848730    54.73
 C   -0.82408036   1.88285230   0.42834331   202.99
 C    0.13377763   2.67712121  -0.28714842   112.39
 C    1.56117989   2.67264016   0.09269007   190.79
 C    1.87468076   2.02384855   1.43937008    39.41
 C    1.99953043  -3.03321929  -0.44375194   198.73
 O   -0.47042102  -4.23199757  -1.05082788
 C   -3.00974078  -3.15065926  -0.71627248     1.46
 O   -3.02301534  -0.54923318   0.43318218
 C    3.32794714  -2.38704087  -0.12410797    27.00
 O    2.00681499  -4.16698474  -0.97947984
 O   -2.07387767   1.97434125   0.17870545
 C   -0.34120012   3.48430600  -1.35425554   200.09
 O    2.44935404   3.20000330  -0.56245829
 C    0.52190477   4.31991075  -2.23781365    23.11
 O   -1.61690760   3.53510699  -1.62448844
 C   -1.19185029   0.98828548   2.75832276    19.32
 H    1.26604280   0.42151273   2.75433589     4.87
 H    1.61435731   2.75370905   2.22831828     2.78
 H    2.96011671   1.85165969   1.49201287     2.96
 H    0.53549509  -4.45323918  -1.13915690    16.86
 H   -3.84974002  -2.44653740  -0.78160103     2.05
 H   -3.28508357  -3.95054071  -0.00747584     2.05
 H   -2.85053103  -3.62959087  -1.69407139     2.05
 H   -2.86369755   0.43187114   0.47059924    10.03
 H    3.42714995  -1.42016354  -0.64049143     2.41
 H    4.12399057  -3.07313958  -0.44214387     2.41
 H    3.41065348  -2.17800038   0.95318209     2.41
 H   -2.07810563   2.89375325  -0.91325506    19.29
 H   -0.11960175   4.88949200  -2.92336272     2.63
 H    1.21959543   3.67899041  -2.79809879     2.63
 H    1.16008819   4.98562537  -1.63849794     2.63
 H   -0.98298532   0.13373378   3.41896861     1.65
 H   -0.88348728   1.91694532   3.26783440     1.65
 H   -2.27519728   1.03677509   2.58572919     1.65
