%chk=000253611.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253611

0 1
O -0.103834 0.880047 -2.213317
O 0.048502 2.184254 1.244825
O -1.549705 2.147563 -1.211383
O -1.331445 0.831536 2.228736
O -4.283328 -1.856035 -0.602175
O 5.341278 -0.339420 -0.081600
O 4.243495 1.527445 -0.071948
N -0.776428 1.215564 -1.269366
N -0.667132 1.209173 1.291694
N 4.311509 0.312468 -0.068683
C -0.694999 0.309019 0.008236
C -1.955795 -0.570223 0.011572
C 0.611585 -0.458810 -0.002492
C -3.280026 0.183556 0.134898
C 1.822147 0.255279 -0.023226
C 0.642471 -1.863186 -0.009184
C -4.450272 -0.727088 -0.199905
C 3.032550 -0.445270 -0.044769
C 1.861760 -2.548574 -0.029852
C 3.067899 -1.848107 -0.049402
C -5.806628 -0.126974 0.002066
H -1.974339 -1.199389 -0.912119
H -1.888192 -1.294134 0.858974
H -3.317885 1.081083 -0.523544
H -3.402267 0.588142 1.165424
H 1.837412 1.358066 -0.019135
H -0.282708 -2.446996 -0.000604
H 1.868389 -3.641301 -0.035053
H 4.031752 -2.372066 -0.069236
H -6.012355 0.073846 1.063097
H -5.932149 0.822679 -0.535436
H -6.598562 -0.807147 -0.352495


%chk=000253611-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000253611

0 1
O -0.189776 1.185906 -2.111577
O 0.176168 2.016448 1.640341
O -1.434071 2.484242 -0.710124
O -1.543790 0.719003 2.380015
O -4.287537 -2.024184 -0.193810
O 5.423591 -0.411097 -0.333160
O 4.268766 1.554726 -0.409815
N -0.745829 1.441507 -0.988754
N -0.697270 1.095336 1.498183
N 4.329658 0.271774 -0.308884
C -0.686565 0.303141 0.109004
C -1.959057 -0.546223 -0.039685
C 0.629654 -0.458990 0.030135
C -3.299303 0.207196 -0.116705
C 1.849119 0.247934 -0.110895
C 0.653532 -1.873071 0.130527
C -4.475440 -0.778968 -0.143576
C 3.050705 -0.478298 -0.153265
C 1.877965 -2.576842 0.089118
C 3.095412 -1.885204 -0.054844
C -5.867807 -0.171918 -0.087601
H -1.841104 -1.173792 -0.940927
H -2.002777 -1.232815 0.823222
H -3.372264 0.840090 -1.022983
H -3.433813 0.891889 0.741492
H 1.887849 1.337845 -0.184762
H -0.274380 -2.440485 0.239276
H 1.877162 -3.667958 0.167800
H 4.059054 -2.399504 -0.092704
H -6.090360 0.136063 0.953107
H -5.944163 0.733881 -0.715352
H -6.620628 -0.912632 -0.398198


