%chk=000170146.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000170146

0 1
 O   -4.346400      0.1854000       1.328500    
 O   -2.336700     -0.9343000       1.247000    
 O    8.632100     -0.6189000      -1.051000    
 O    8.502100      -1.714700      0.8466000    
 N   -3.197400       2.414800     -2.3800001E-02
 N    2.258600       1.238000     -0.3270000    
 N    2.493100      0.1439000      0.2380000    
 N    7.973500      -1.039000     -6.9200002E-02
 C   -3.869500       2.546000       1.248100    
 C   -3.980000       2.583200      -1.248900    
 C   -1.829400       2.119800     -9.9799998E-02
 C   -3.729200       1.260200       2.045100    
 C   -3.430400       3.737100      -2.065100    
 C  -0.9657000       2.551800      0.9068000    
 C   -1.331500       1.394400      -1.182300    
 C   0.3957000       2.258100      0.8311000    
 C   2.9999999E-02   1.100700      -1.257900    
 C   0.8935000       1.532500     -0.2512000    
 C   -3.543900     -0.8667000      0.9797000    
 C   -4.285100      -1.888500      0.2581000    
 C   -3.638700      -2.678600     -0.6926000    
 C   -5.642600      -2.079400      0.5168000    
 C    3.864900     -0.1518000      0.1614000    
 C   -4.349500      -3.659100      -1.384600    
 C   -6.353300      -3.060000     -0.1753000    
 C   -5.706800      -3.849800      -1.126000    
 C    4.617200      0.3036000     -0.9214000    
 C    4.474000     -0.9017000       1.167700    
 C    6.587500     -0.7405000      8.2999999E-03
 C    5.978400      9.3999999E-03 -0.9980000    
 C    5.835400      -1.195900       1.091300    
 H   -4.938700       2.740700       1.099200    
 H   -3.487700       3.402000       1.815200    
 H   -4.011300       1.658800      -1.835900    
 H   -5.026400       2.808300      -1.010100    
 H   -4.287600       1.368900       2.982100    
 H   -2.696900       1.047100       2.336400    
 H   -4.084500       3.930800      -2.922000    
 H   -2.430000       3.542800      -2.461400    
 H   -3.382000       4.654000      -1.467500    
 H   -1.310100       3.134700       1.755400    
 H   -1.969300       1.019700      -1.976500    
 H    1.061700       2.602900       1.617800    
 H   0.4082000      0.5311000      -2.103000    
 H   -2.582300      -2.540400     -0.9087000    
 H   -6.170100      -1.487600       1.260300    
 H   -3.846500      -4.273600      -2.125500    
 H   -7.409500      -3.210700      2.7799999E-02
 H   -6.260200      -4.613600      -1.664500    
 H    4.177500      0.8722000      -1.737000    
 H    3.894900      -1.260200       2.014700    
 H    6.532400      0.3766000      -1.858200    
 H    6.276100      -1.782200       1.893500    


%chk=000170146-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000170146

0 1
O -4.874985 0.108070 0.999327
O -4.980284 -1.298422 2.852219
O 9.893388 0.473533 1.171359
O 10.092282 -0.042110 -1.044223
N -2.594075 1.594858 -0.330013
N 3.019573 1.063720 0.309612
N 3.750719 0.747626 -0.744509
N 9.387992 0.269535 -0.003305
C -3.434387 2.049312 0.792989
C -3.289258 1.319323 -1.611012
C -1.214635 1.456379 -0.194060
C -3.881730 0.929123 1.742414
C -3.300293 2.528132 -2.574134
C -0.559470 1.649828 1.070807
C -0.387443 1.112062 -1.323647
C 0.827576 1.513350 1.187658
C 0.994022 0.971930 -1.196197
C 1.636174 1.172581 0.066005
C -5.362951 -1.015598 1.691103
C -6.354217 -1.788236 0.892036
C -6.889894 -2.970218 1.468071
C -6.772411 -1.380121 -0.401585
C 5.146493 0.648445 -0.467489
C -7.833151 -3.737567 0.755276
C -7.717903 -2.150289 -1.110330
C -8.249056 -3.329215 -0.534735
C 5.749288 0.864955 0.809669
C 5.963547 0.306150 -1.582242
C 7.927138 0.399681 -0.164653
C 7.136811 0.741075 0.961895
C 7.354589 0.179590 -1.439374
H -4.334104 2.538011 0.378429
H -2.899870 2.817957 1.380792
H -2.827068 0.439941 -2.093946
H -4.322374 1.023306 -1.361762
H -4.367698 1.342725 2.646072
H -3.043920 0.283626 2.057773
H -3.835867 2.269226 -3.505942
H -2.276189 2.842525 -2.839960
H -3.811996 3.394071 -2.116470
H -1.134636 1.894762 1.967210
H -0.839058 0.967050 -2.308499
H 1.323768 1.658560 2.153067
H 1.614464 0.713674 -2.059877
H -6.554380 -3.265104 2.467771
H -6.359135 -0.466014 -0.836815
H -8.243797 -4.649667 1.200941
H -8.041996 -1.834697 -2.107846
H -8.982984 -3.925736 -1.087872
H 5.104960 1.126762 1.653404
H 5.475243 0.145893 -2.548351
H 7.628653 0.900176 1.925278
H 8.002132 -0.082233 -2.279828


