%chk=000294942.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000294942

0 1
O 3.414339 -0.781499 -0.418377
O 2.746205 -1.667504 1.569256
O -1.803986 -1.511665 0.559574
O 0.201740 2.793525 2.345300
O 0.458506 3.011950 0.128591
O -0.759116 -0.560972 -1.258196
N 0.185128 -0.519850 0.879051
C 4.623951 -1.653763 -0.597539
C 1.445374 0.120121 0.474553
C 4.150127 -3.095595 -0.679717
C 5.142715 -1.114168 -1.925109
C 5.566659 -1.394247 0.566942
C 2.592871 -0.902474 0.646928
C 1.756660 1.331363 1.368718
C 0.765691 2.436901 1.141903
C -0.783575 -0.828358 -0.075096
C -3.008126 -1.759829 -0.240453
C -3.903837 -0.555874 -0.192462
C -4.987103 -0.516332 0.696600
C -3.656024 0.532855 -1.042109
C -5.824453 0.602797 0.725874
C -4.493364 1.650164 -1.006247
C -5.579530 1.685243 -0.125107
H 1.380787 0.440567 -0.612643
H 4.970838 -3.776001 -0.931420
H 3.368931 -3.223331 -1.439656
H 3.724645 -3.435692 0.277890
H 4.384156 -1.201828 -2.715452
H 5.398324 -0.049025 -1.856509
H 6.035598 -1.656330 -2.253779
H 5.799074 -0.328869 0.675033
H 5.128682 -1.730624 1.520364
H 6.515162 -1.928310 0.440266
H 2.778909 1.716723 1.143971
H 1.775254 1.041431 2.446758
H 0.099207 -0.861596 1.837794
H -3.418664 -2.644157 0.283190
H -2.707670 -2.028965 -1.271739
H -5.176641 -1.352186 1.367858
H -2.798609 0.507432 -1.722839
H -0.473991 3.519522 2.255703
H -6.666928 0.631556 1.414511
H -4.297039 2.495007 -1.665165
H -6.232777 2.555691 -0.100813


%chk=000294942-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000294942

0 1
O 3.591452 -0.691041 -0.342851
O 2.321614 -2.163846 0.978685
O -1.932944 -1.283239 0.873620
O 0.950009 3.290677 1.979700
O 0.533333 2.832746 -0.259783
O -0.910148 -0.727508 -1.183836
N 0.149932 -0.384986 0.887672
C 4.802318 -1.624195 -0.510585
C 1.420191 0.055597 0.326142
C 4.346302 -2.899121 -1.245661
C 5.741952 -0.770701 -1.377056
C 5.407694 -1.915818 0.875953
C 2.473747 -1.078953 0.373457
C 1.964869 1.308937 1.059139
C 1.077644 2.516904 0.817949
C -0.889755 -0.790595 0.072665
C -3.172560 -1.697217 0.131995
C -4.166016 -0.560143 0.025730
C -5.236662 -0.452601 0.948808
C -4.038274 0.410791 -1.002330
C -6.166041 0.607506 0.851454
C -4.964642 1.472080 -1.098315
C -6.031106 1.572596 -0.173473
H 1.238381 0.313863 -0.732746
H 5.230491 -3.520377 -1.478146
H 3.848664 -2.640894 -2.196856
H 3.653729 -3.491790 -0.627854
H 5.257403 -0.506905 -2.332480
H 6.016545 0.162245 -0.855153
H 6.665932 -1.335428 -1.595098
H 5.655064 -0.974683 1.398698
H 4.715313 -2.504073 1.498074
H 6.342433 -2.491809 0.748984
H 2.969423 1.537173 0.657197
H 2.066637 1.134627 2.143733
H 0.095963 -0.637459 1.876005
H -3.562850 -2.526522 0.742612
H -2.860710 -2.061101 -0.862343
H -5.341125 -1.199900 1.745415
H -3.205279 0.332460 -1.710143
H 0.379630 4.083970 1.784481
H -6.991797 0.679752 1.568246
H -4.857007 2.218013 -1.893681
H -6.751647 2.394773 -0.251820


