%chk=000233496.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000233496

0 1
O -5.341657 -1.823528 -0.250202
O 5.066451 1.084777 0.460052
O 3.921267 -2.703939 -0.261471
O 5.519707 -1.314227 0.170639
N 4.350396 -1.579152 -0.036119
C -2.778034 0.585229 -0.386155
C -3.175147 -0.774089 0.269296
C -1.355871 0.969582 0.032617
C -0.399091 -0.114100 -0.549720
C -2.276249 -1.865159 -0.322113
C -3.961111 1.519508 -0.067725
C -0.796963 -1.527238 -0.063386
C -0.932644 2.347245 -0.493943
C -4.676999 -0.835350 -0.081892
C -5.194647 0.598568 -0.172893
C 1.044986 0.225359 -0.242977
C -3.117220 -0.789231 1.803482
C 0.459167 2.705561 0.036310
C 1.441892 1.569282 -0.000093
C 2.013515 -0.771985 -0.257140
C 2.785654 1.871077 0.238593
C 3.374779 -0.488225 -0.016956
C 3.749583 0.848166 0.232594
H -2.772951 0.443315 -1.499951
H -1.276764 0.970696 1.145972
H -0.499756 -0.099634 -1.668407
H -2.465248 -1.976053 -1.406672
H -2.522424 -2.851055 0.118962
H -4.021172 2.362435 -0.773442
H -3.873386 1.958532 0.940092
H -0.579695 -1.621003 1.019195
H -0.164966 -2.287049 -0.565471
H -1.661551 3.120266 -0.185463
H -0.934640 2.356265 -1.601197
H -5.740362 0.745062 -1.122282
H -5.933036 0.792377 0.624146
H -2.086320 -0.691087 2.165893
H -3.697071 0.025033 2.250800
H -3.509075 -1.735519 2.198955
H 0.376661 3.060589 1.088969
H 0.858529 3.572198 -0.533101
H 1.742180 -1.819183 -0.460207
H 3.091736 2.896462 0.428169
H 5.257648 2.049023 0.626642


%chk=000233496-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000233496

0 1
O -5.384936 -1.868775 -0.302889
O 5.192348 1.198460 0.362836
O 3.865948 -2.799860 -0.215957
O 5.635197 -1.402620 0.102005
N 4.373540 -1.615881 -0.045644
C -2.796402 0.602521 -0.324466
C -3.211247 -0.778876 0.269464
C -1.357930 0.986822 0.059585
C -0.400163 -0.118197 -0.496107
C -2.297823 -1.878859 -0.308427
C -3.991886 1.534830 0.008748
C -0.804255 -1.550273 -0.033612
C -0.916970 2.360032 -0.490831
C -4.700937 -0.833738 -0.123561
C -5.221621 0.617249 -0.255162
C 1.070297 0.230365 -0.221655
C -3.208855 -0.821203 1.831993
C 0.478914 2.733144 0.048631
C 1.481574 1.585387 -0.011226
C 2.066798 -0.764083 -0.218771
C 2.848587 1.874362 0.178105
C 3.436960 -0.473025 -0.023883
C 3.851889 0.875481 0.175335
H -2.802557 0.473118 -1.433136
H -1.268799 1.019642 1.166719
H -0.536122 -0.096793 -1.603376
H -2.464256 -1.951690 -1.402139
H -2.552649 -2.866848 0.117349
H -4.012774 2.442855 -0.618253
H -3.959676 1.863538 1.064488
H -0.574872 -1.665143 1.043739
H -0.188873 -2.302317 -0.561367
H -1.640621 3.146041 -0.204105
H -0.902430 2.321033 -1.599255
H -5.612779 0.744881 -1.283205
H -6.074973 0.783930 0.426514
H -2.190245 -0.713796 2.240828
H -3.834019 -0.027029 2.277947
H -3.609993 -1.794106 2.168006
H 0.380580 3.049057 1.108513
H 0.884163 3.609279 -0.493415
H 1.820063 -1.817100 -0.370359
H 3.151024 2.919905 0.334554
H 5.290883 2.178082 0.487843


