%chk=000173327.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000173327

0 1
 O    5.528700     -9.3000002E-02 -0.1759000    
 N   -2.302900     -6.9399998E-02  0.4908000    
 C  -0.8697000      0.1073000      0.7200000    
 C  -0.3224000      -1.058300       1.546000    
 C  -0.1212000      0.1997000     -0.6168000    
 C    1.149800     -0.8236000       1.885200    
 C    1.379100      0.1344000     -0.4606000    
 C    1.975900     -0.3863000      0.7020000    
 C   -2.552400      -1.295700     -0.2661000    
 C   -2.854400       1.087300     -0.2142000    
 C   -4.051700      -1.494800     -0.4733000    
 C   -2.678400       2.351500      0.6232000    
 C    2.192800      0.5486000      -1.526300    
 C    3.375100     -0.4478000      0.7893000    
 C    4.172900     -2.3200000E-02 -0.2728000    
 C    3.581900      0.4725000      -1.431000    
 C   -4.339500      -2.776200      -1.240400    
 C   -3.263500       3.567000     -7.9099998E-02
 H  -0.6647000      0.9938000       1.327900    
 H  -0.3632000      -2.007000      0.9989000    
 H  -0.8920000      -1.189300       2.474100    
 H  -0.3531000       1.148600      -1.114100    
 H  -0.3453000     -0.6100000      -1.314000    
 H    1.565100      -1.746200       2.308700    
 H    1.223000     -4.6000000E-02   2.655900    
 H   -2.108000      -1.304600      -1.264400    
 H   -2.206100      -2.183800      0.2693000    
 H   -2.461300       1.217200      -1.228800    
 H   -3.939500      0.9968000     -0.3172000    
 H   -4.572400      -1.525200      0.4913000    
 H   -4.502800     -0.6998000      -1.073400    
 H   -3.156800       2.233500       1.602900    
 H   -1.627700       2.599600      0.7945000    
 H    1.745400      0.9337000      -2.439500    
 H    3.845400     -0.8300000       1.692700    
 H    4.190800      0.8031000      -2.268200    
 H   -3.871600      -2.757700      -2.230100    
 H   -3.964100      -3.650600     -0.6991000    
 H   -5.418200      -2.902200      -1.378100    
 H   -2.774300       3.737300      -1.043600    
 H   -4.336500       3.440500     -0.2554000    
 H   -3.125600       4.463200      0.5342000    
 H    5.921300      0.2421000      -1.000300    


%chk=000173327-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000173327

0 1
O 5.806531 -0.144586 0.209548
N -2.207752 0.034886 0.074417
C -0.743875 0.106201 0.334931
C -0.272842 -0.947589 1.363262
C 0.146401 0.003315 -0.938267
C 1.167416 -0.637904 1.826922
C 1.640475 -0.005854 -0.622555
C 2.126488 -0.348276 0.673486
C -2.693194 -1.168900 -0.642775
C -2.795741 1.311655 -0.403020
C -4.104067 -1.601659 -0.181485
C -3.101267 2.304712 0.741882
C 2.578444 0.303720 -1.637957
C 3.520374 -0.385494 0.911388
C 4.435839 -0.080900 -0.115844
C 3.968862 0.270800 -1.404852
C -4.626147 -2.828024 -0.961252
C -3.672762 3.641284 0.220628
H -0.564791 1.100010 0.794723
H -0.306306 -1.959869 0.912771
H -0.965260 -0.943480 2.224679
H -0.083187 0.833519 -1.634541
H -0.117411 -0.933507 -1.472708
H 1.561454 -1.472311 2.438217
H 1.145179 0.247446 2.496851
H -2.705094 -1.027297 -1.753257
H -1.996094 -2.004534 -0.443627
H -2.141224 1.817149 -1.156533
H -3.743559 1.083565 -0.927294
H -4.063320 -1.818662 0.902698
H -4.810480 -0.756639 -0.303720
H -3.813125 1.823269 1.438870
H -2.177867 2.497128 1.322814
H 2.212271 0.574814 -2.636077
H 3.911951 -0.649567 1.899955
H 4.674047 0.514462 -2.210305
H -4.691266 -2.614864 -2.045464
H -3.955919 -3.699196 -0.831592
H -5.632959 -3.124491 -0.615175
H -2.956469 4.146511 -0.455145
H -4.610358 3.480778 -0.345446
H -3.896903 4.333415 1.052435
H 6.361404 0.081965 -0.577386


