%chk=000158734.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000158734

0 1
 O   -1.294800      -3.485100       1.096500    
 O   -2.264000      -3.166300     -0.8563000    
 O   -4.232500       2.744300      0.2763000    
 O    5.041000       1.620300      0.2248000    
 N   -1.331400      -3.031700     -5.4200001E-02
 C  -0.1614000      -2.236000     -0.5083000    
 C   2.4499999E-02 -0.9567000      0.3808000    
 C   -1.131200      4.8300002E-02  0.3524000    
 C    1.387600     -0.2566000      0.3382000    
 C    1.045700      -3.183600     -0.4158000    
 C  -0.4142000      -1.891900      -1.983500    
 C   -1.898300      0.1991000       1.483300    
 C    2.186600     -0.3092000       1.455100    
 C   -1.354900      0.7593000     -0.8032000    
 C    1.754200      0.3947000     -0.8152000    
 C   -2.950800       1.114100       1.457300    
 C    3.426700      0.3281000       1.416500    
 C   -2.407300       1.674400     -0.8292000    
 C    2.994500       1.031900     -0.8540000    
 C   -3.205400       1.851900      0.3011000    
 C    3.830900      0.9985000      0.2620000    
 C   -4.437100       3.465400     -0.9379000    
 C    5.391700       2.287000     -0.9868000    
 H  -8.0000004E-03  -1.363800       1.404600    
 H    1.297100      -3.425100      0.6239000    
 H    1.937100      -2.743100     -0.8761000    
 H   0.8554000      -4.133000     -0.9321000    
 H  -0.4688000      -2.812900      -2.583600    
 H   0.4087000      -1.334400      -2.432700    
 H   -1.352100      -1.367500      -2.184200    
 H   -1.712700     -0.3681000       2.389900    
 H    1.886800     -0.8276000       2.360400    
 H  -0.7849000      0.6649000      -1.713700    
 H    1.169400      0.4353000      -1.718800    
 H   -3.569200       1.247800       2.340700    
 H    4.074000      0.2986000       2.288800    
 H   -2.551600       2.212900      -1.759800    
 H    3.249200       1.529300      -1.783700    
 H   -5.293100       4.129500     -0.7791000    
 H   -4.700700       2.796100      -1.763800    
 H   -3.578700       4.102100      -1.177300    
 H    4.706100       3.112900      -1.204800    
 H    5.474400       1.584500      -1.823100    
 H    6.383800       2.725900     -0.8388000    


%chk=000158734-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000158734

0 1
O -1.200010 -3.327731 1.411152
O -2.345690 -3.294169 -0.546870
O -4.633414 2.499979 0.199164
O 5.225663 1.667342 0.171362
N -1.319827 -3.010834 0.166654
C -0.110363 -2.225891 -0.490264
C 0.045644 -0.912851 0.401074
C -1.162536 0.035437 0.291718
C 1.409960 -0.232433 0.236393
C 1.108327 -3.162209 -0.319147
C -0.457841 -1.997811 -1.966902
C -2.279794 -0.171092 1.150605
C 2.200995 -0.036370 1.403447
C -1.226491 1.121308 -0.613524
C 1.940826 0.240243 -0.990135
C -3.413381 0.657384 1.096207
C 3.455123 0.595983 1.355744
C -2.357895 1.965789 -0.684747
C 3.202623 0.873930 -1.063153
C -3.459945 1.730442 0.172721
C 3.964897 1.055083 0.116303
C -4.727104 3.620937 -0.737986
C 5.792900 2.163614 -1.084545
H 0.034742 -1.314201 1.432464
H 1.301987 -3.367203 0.746626
H 2.000203 -2.682362 -0.753489
H 0.937831 -4.121332 -0.839800
H -0.738938 -2.948812 -2.448519
H 0.427427 -1.602193 -2.491432
H -1.296193 -1.294152 -2.087625
H -2.260343 -0.991389 1.877822
H 1.820201 -0.384877 2.370949
H -0.375676 1.340998 -1.265138
H 1.378987 0.118620 -1.921371
H -4.269200 0.495138 1.758172
H 4.055023 0.743781 2.258698
H -2.361671 2.796758 -1.396744
H 3.571425 1.219639 -2.033620
H -5.713634 4.069939 -0.551343
H -4.668009 3.274480 -1.788412
H -3.934527 4.371591 -0.550091
H 5.150938 2.945478 -1.535271
H 5.943608 1.341744 -1.811553
H 6.765453 2.596772 -0.808996


