%chk=000116735.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000116735

0 1
 O    1.241000       1.767700     -7.9499997E-02
 C   -1.627400       1.450000      0.5685000    
 C   -2.086500      0.6222000     -0.6546000    
 C  -0.9304000       2.755100      0.1404000    
 C   -2.767600     -0.7162000     -0.3340000    
 C   -2.842800       1.729400       1.461600    
 C   0.2709000       2.542000     -0.7744000    
 C   -1.857800      -1.674400      0.3827000    
 C    2.390600       1.532600     -0.8805000    
 C    3.385200      0.7024000     -8.1699997E-02
 C    2.799100     -0.6489000      0.3175000    
 C  -0.9545000      -2.523000     -0.1440000    
 C    3.810100      -1.492000       1.077800    
 C  -7.4100003E-02  -3.457400      0.6359000    
 C  -0.7558000      -2.589400      -1.635600    
 H  -0.9114000      0.8598000       1.153700    
 H   -1.229500      0.4060000      -1.300700    
 H   -2.780100       1.224600      -1.255900    
 H   -1.650100       3.409900     -0.3658000    
 H  -0.5975000       3.279600       1.045100    
 H   -3.133200      -1.164900      -1.265000    
 H   -3.671600     -0.5653000      0.2660000    
 H   -3.656200       2.196800      0.8966000    
 H   -3.222700      0.8171000       1.930200    
 H   -2.568100       2.410200       2.275000    
 H   0.7048000       3.520300      -1.014300    
 H  -6.6999998E-03   2.064800      -1.718900    
 H   -1.951900      -1.657400       1.467900    
 H    2.104800       1.002600      -1.796700    
 H    2.850100       2.489000      -1.155100    
 H    4.294300      0.5568000     -0.6764000    
 H    3.666600       1.249000      0.8267000    
 H    1.911300     -0.5111000      0.9455000    
 H    2.479900      -1.194700     -0.5782000    
 H    4.697300      -1.686600      0.4669000    
 H    4.128400     -0.9889000       1.996400    
 H    3.370200      -2.455400       1.353600    
 H  -0.2369000      -3.356700       1.713900    
 H   0.9810000      -3.247600      0.4361000    
 H  -0.2823000      -4.496200      0.3605000    
 H   -1.012500      -3.589800      -2.000500    
 H   -1.345300      -1.871900      -2.209300    
 H   0.2956000      -2.398400      -1.877800    


%chk=000116735-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000116735

0 1
O 1.270613 1.886822 -0.045922
C -1.632276 1.449841 0.517518
C -2.176746 0.650652 -0.696348
C -0.981876 2.789179 0.071899
C -2.793025 -0.740940 -0.356879
C -2.735947 1.736366 1.563042
C 0.268837 2.645855 -0.804319
C -1.836335 -1.671761 0.368240
C 2.519619 1.693209 -0.793424
C 3.426814 0.776062 0.034488
C 2.864842 -0.654936 0.193143
C -1.005350 -2.600365 -0.188892
C 3.760052 -1.548244 1.077930
C -0.080898 -3.444856 0.674195
C -0.901542 -2.868125 -1.680641
H -0.836809 0.846293 0.996547
H -1.354809 0.483150 -1.420106
H -2.945869 1.263343 -1.215733
H -1.727645 3.397211 -0.483290
H -0.701550 3.368103 0.973971
H -3.141718 -1.201876 -1.301131
H -3.697504 -0.595691 0.265267
H -3.566628 2.317417 1.115053
H -3.162932 0.806631 1.980434
H -2.331761 2.324047 2.408724
H 0.672933 3.651327 -1.063291
H 0.042114 2.118079 -1.757758
H -1.800251 -1.558468 1.462941
H 2.299679 1.234555 -1.785891
H 3.006026 2.679436 -0.971120
H 4.425345 0.736922 -0.447887
H 3.568778 1.233097 1.033702
H 1.846808 -0.589408 0.620483
H 2.755611 -1.114383 -0.811819
H 4.777372 -1.644846 0.652245
H 3.861407 -1.121570 2.093798
H 3.339890 -2.566039 1.182252
H -0.209188 -3.225322 1.748614
H 0.981324 -3.263854 0.412339
H -0.266029 -4.526707 0.518555
H -1.084286 -3.938539 -1.902368
H -1.610217 -2.268824 -2.275243
H 0.121425 -2.641142 -2.043718


