%chk=000101996.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000101996

0 1
 O    4.127300     -0.1235000      -1.012900    
 O   -5.565200     -0.1217000      -1.476800    
 O    5.686800       1.263700     -2.2800000E-02
 C  -0.5176000     -0.5555000     -0.2005000    
 C   0.8654000     -0.9844000      0.4167000    
 C   -1.283100      0.4480000      0.7258000    
 C   -2.584700      0.8452000      2.3399999E-02
 C    1.680000      0.3219000      0.6846000    
 C   -3.497600     -0.3743000     -0.2194000    
 C   -1.416100      -1.739100     -0.6530000    
 C  -0.4189000       1.672300       1.055900    
 C   -2.787700      -1.301500      -1.200400    
 C   0.9457000       1.286900       1.623100    
 C    1.673500      -1.845400     -0.5950000    
 C   -3.506300       1.881500      0.6571000    
 C    3.111500      4.5299999E-02   1.174900    
 C   0.6563000      -1.815500       1.708700    
 C   -4.715400      0.3656000     -0.7431000    
 C    3.117500      -2.118400     -0.1540000    
 C   -4.768800       1.788600     -0.2126000    
 C    3.880400     -0.8433000      0.1950000    
 C   -3.954500      -1.135400       1.038900    
 C    4.839600       1.032600     -0.8749000    
 C    4.431800       2.006300      -1.938600    
 H  -0.2841000     -4.0000002E-03  -1.125600    
 H   -1.529600     -3.9000001E-02   1.674700    
 H   -2.297500       1.268500     -0.9551000    
 H    1.777300      0.8487000     -0.2769000    
 H   -1.575300      -2.433600      0.1778000    
 H  -0.9113000      -2.309900      -1.440300    
 H  -0.9345000       2.312100       1.781600    
 H  -0.2721000       2.277000      0.1516000    
 H   -2.647800     -0.7973000      -2.165600    
 H   -3.400200      -2.186800      -1.410400    
 H    1.539100       2.199900       1.756200    
 H   0.8273000      0.8475000       2.620000    
 H    1.694000      -1.340200      -1.569600    
 H    1.181300      -2.811400     -0.7578000    
 H   -3.085500       2.891500      0.6308000    
 H   -3.728700       1.640300       1.702100    
 H    3.617400       1.002200       1.339900    
 H    3.083600     -0.4425000       2.156200    
 H    1.598600      -2.057800       2.207600    
 H   3.8800001E-02  -1.299700       2.447900    
 H   0.1705000      -2.772200       1.490100    
 H    3.119100      -2.795100      0.7078000    
 H    3.630900      -2.643300     -0.9691000    
 H   -4.717200       2.482300      -1.056700    
 H   -5.674700       1.955100      0.3741000    
 H    4.847700      -1.127900      0.6279000    
 H   -3.122200      -1.567900       1.600200    
 H   -4.520600     -0.5005000       1.729000    
 H   -4.622800      -1.959400      0.7605000    
 H    3.373800       2.255900      -1.827200    
 H    4.625100       1.579600      -2.926000    
 H    5.019300       2.923200      -1.835200    


%chk=000101996-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000101996

0 1
O 4.045493 0.125955 -1.022417
O -5.664541 -0.167419 -1.604418
O 5.907442 1.172033 -0.075061
C -0.576515 -0.506952 -0.132941
C 0.821386 -0.929823 0.465202
C -1.381822 0.437086 0.829888
C -2.694109 0.834428 0.125183
C 1.604732 0.393402 0.796899
C -3.576144 -0.393627 -0.250620
C -1.437356 -1.706044 -0.633800
C -0.546029 1.680542 1.221515
C -2.803397 -1.284317 -1.243206
C 0.838683 1.298697 1.785644
C 1.651317 -1.693809 -0.616286
C -3.687177 1.825689 0.791402
C 3.057241 0.134575 1.257763
C 0.645712 -1.834388 1.716760
C -4.846327 0.301994 -0.777441
C 3.117815 -1.962778 -0.200599
C -4.955668 1.688800 -0.100211
C 3.857688 -0.691625 0.235591
C -4.063363 -1.222507 0.981906
C 5.114588 1.025587 -1.034171
C 5.163567 1.767644 -2.354068
H -0.343376 0.112897 -1.032169
H -1.627989 -0.113528 1.762356
H -2.395607 1.302210 -0.843754
H 1.673940 0.950348 -0.164777
H -1.614820 -2.415942 0.197194
H -0.874970 -2.267138 -1.403286
H -1.104466 2.290393 1.958465
H -0.407044 2.316133 0.320398
H -2.631798 -0.717509 -2.180656
H -3.394801 -2.178856 -1.515555
H 1.431284 2.214923 1.982103
H 0.723197 0.787099 2.762862
H 1.651704 -1.098460 -1.551725
H 1.171318 -2.662953 -0.850400
H -3.303943 2.860268 0.812646
H -3.900680 1.533218 1.836846
H 3.577419 1.094872 1.435573
H 3.071566 -0.406792 2.225592
H 1.610428 -2.043493 2.211722
H -0.014318 -1.378895 2.475080
H 0.208263 -2.809910 1.436148
H 3.151850 -2.676994 0.645339
H 3.667296 -2.434705 -1.036517
H -4.975716 2.454373 -0.900227
H -5.913949 1.778636 0.442558
H 4.868458 -0.914276 0.624492
H -3.220878 -1.706318 1.503372
H -4.602057 -0.602291 1.720701
H -4.753889 -2.013427 0.637759
H 4.242267 2.361094 -2.489717
H 5.220013 1.052762 -3.192819
H 6.037685 2.434321 -2.371516


