%chk=000114503.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000114503

0 1
 O   -2.572300     -0.7224000     -0.8806000    
 C   0.7691000      0.8316000     -1.1600000E-02
 C  -0.3261000      0.1754000     -0.8830000    
 C    1.297700     -0.3566000      0.8289000    
 C   0.4578000      -1.544200      0.3130000    
 C   0.2765000      -1.211500      -1.169500    
 C   -1.551900     -0.2221000     -1.2200000E-02
 C  -0.9880000      -1.387500      0.8413000    
 C    1.978000       1.373800     -0.7776000    
 C    2.796700     -0.4442000      0.5359000    
 C    3.168400      0.9562000      7.2300002E-02
 C   -2.151600      0.8888000      0.7863000    
 C   -3.154200       1.662600      0.3568000    
 H   0.3771000       1.624100      0.6344000    
 H  -0.5779000      0.7367000      -1.787000    
 H    1.137600     -0.1817000       1.899500    
 H   0.8932000      -2.522800      0.5256000    
 H    1.212900      -1.179800      -1.732700    
 H  -0.4123000      -1.892300      -1.681000    
 H   -1.552700      -2.310900      0.6655000    
 H  -0.9924000      -1.185400       1.917900    
 H    1.926400       2.460800     -0.8962000    
 H    2.055900      0.9414000      -1.781100    
 H    3.015800      -1.175400     -0.2505000    
 H    3.364900     -0.7409000       1.423000    
 H    3.272900       1.625900      0.9341000    
 H    4.106300      0.9724000     -0.4898000    
 H   -1.724900       1.106300       1.762500    
 H   -2.601800     -0.1696000      -1.679800    
 H   -3.526600       2.463400      0.9876000    
 H   -3.621600       1.540300     -0.6130000    


%chk=000114503-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000114503

0 1
O -2.538007 -0.720694 -1.047673
C 0.855543 0.864263 -0.045107
C -0.239961 0.241081 -0.965418
C 1.320028 -0.363932 0.847124
C 0.424475 -1.526641 0.317179
C 0.319482 -1.193678 -1.199110
C -1.540091 -0.098022 -0.140524
C -1.037353 -1.265754 0.790995
C 2.134520 1.359813 -0.782987
C 2.849950 -0.509815 0.602970
C 3.307367 0.891078 0.117436
C -2.159965 1.065018 0.607586
C -3.477594 1.386017 0.605781
H 0.461722 1.690913 0.572186
H -0.457711 0.842178 -1.866235
H 1.124463 -0.182662 1.921304
H 0.799009 -2.532704 0.570886
H 1.290505 -1.205822 -1.723236
H -0.392543 -1.840675 -1.736683
H -1.694634 -2.134629 0.615615
H -1.092653 -0.998527 1.860933
H 2.128978 2.452990 -0.944972
H 2.216145 0.881390 -1.778820
H 3.040499 -1.258684 -0.191082
H 3.390586 -0.846488 1.505809
H 3.413056 1.573746 0.983668
H 4.277681 0.871578 -0.411651
H -1.468306 1.669270 1.210473
H -2.837450 -0.026273 -1.690740
H -3.853611 2.239193 1.180627
H -4.211233 0.788869 0.052668


