%chk=000174565.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000174565

0 1
 O    4.895500     -0.6769000     -0.2335000    
 O   -1.271000      -3.148100     -0.5737000    
 O    3.067500       2.235300      -1.091700    
 O    1.620800      -3.175900      0.7381000    
 O    5.492700       1.215300      -1.283600    
 N   0.1249000      -1.458600      0.3328000    
 N   -2.177400       1.275800     -9.3800001E-02
 C    3.391200       1.262200     -9.5700003E-02
 C    2.257700      0.2839000      4.4799998E-02
 C   -1.146000      -2.201800      0.4733000    
 C  -0.1124000     -0.1122000      0.1038000    
 C    2.516600      -1.010600      0.3022000    
 C   -2.166400      -1.119200      0.3170000    
 C   -1.552300      0.1046000      9.0999998E-02
 C   0.8867000      0.7625000     -3.7200000E-02
 C    1.391800      -1.996000      0.4822000    
 C    3.683700       1.980400       1.223900    
 C    3.916600      -1.505800      0.4308000    
 C    4.669400      0.6054000     -0.6036000    
 C   -3.540400      -1.163300      0.3605000    
 C   -4.250400      3.4100000E-02  0.1724000    
 C   -3.524900       1.238000     -5.3700000E-02
 C    4.804800       2.987300       1.064800    
 C   -5.653700      5.3100001E-02  0.2047000    
 C   -1.081700      -2.548800      -1.850100    
 C   -4.249300       2.411200     -0.2374000    
 C   -6.348300       1.244800      1.6400000E-02
 C   -5.645900       2.423300     -0.2047000    
 H   -1.180600      -2.697000       1.448600    
 H   0.6955000       1.818200     -0.1933000    
 H    3.948600       1.267700       2.014500    
 H    2.790800       2.523900       1.558600    
 H    4.204100      -1.590500       1.484000    
 H    4.012500      -2.497300     -2.4000000E-02
 H   -4.053900      -2.104100      0.5349000    
 H    5.774800       2.505700      0.9105000    
 H    4.624600       3.691500      0.2470000    
 H    4.895000       3.577800       1.983600    
 H    2.827700       1.767200      -1.910200    
 H   -6.216700     -0.8618000      0.3766000    
 H   -1.220100      -3.344400      -2.590500    
 H  -6.5099999E-02  -2.174600      -1.999700    
 H   -1.827300      -1.785100      -2.087100    
 H   -3.725300       3.349300     -0.4122000    
 H   -7.433700       1.253100      4.2199999E-02
 H   -6.182400       3.356200     -0.3521000    


%chk=000174565-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000174565

0 1
O 4.838012 -0.685546 -0.469154
O -1.235331 -3.242242 -0.497987
O 3.048682 2.514827 -0.965255
O 1.597965 -3.071931 0.958606
O 5.276157 1.180332 -1.717585
N 0.115745 -1.341566 0.347310
N -2.271366 1.318362 -0.183701
C 3.416311 1.369403 -0.142033
C 2.222987 0.430569 0.005023
C -1.135123 -2.168077 0.478040
C -0.145534 0.004351 0.046423
C 2.484842 -0.896199 0.340666
C -2.208678 -1.098604 0.341958
C -1.607378 0.174459 0.042026
C 0.882690 0.911568 -0.140870
C 1.418599 -1.872397 0.577909
C 3.872305 1.880797 1.270092
C 3.903351 -1.380657 0.479995
C 4.580294 0.619221 -0.841422
C -3.588721 -1.198450 0.408432
C -4.362812 -0.007138 0.182132
C -3.659992 1.234855 -0.114507
C 5.095837 2.815448 1.223217
C -5.792478 0.001784 0.233906
C -1.206841 -2.817575 -1.908979
C -4.417032 2.426273 -0.346490
C -6.505154 1.181788 0.003395
C -5.812872 2.400194 -0.288541
H -1.118154 -2.708639 1.438795
H 0.677850 1.951541 -0.395229
H 4.065842 1.019930 1.938470
H 3.001895 2.421827 1.686751
H 4.310436 -1.233444 1.498358
H 3.981777 -2.449089 0.228280
H -4.089159 -2.150800 0.616818
H 6.002451 2.299044 0.860155
H 4.900988 3.675009 0.559449
H 5.311265 3.206967 2.233117
H 3.785810 2.647841 -1.625915
H -6.322108 -0.932078 0.457062
H -1.273941 -3.752367 -2.484334
H -0.259632 -2.301143 -2.154658
H -2.063314 -2.161410 -2.159090
H -3.862538 3.343250 -0.567047
H -7.599514 1.179339 0.044787
H -6.386119 3.316174 -0.466974


