%chk=000190206.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000190206

-1 1
O 4.309506 1.898686 -0.209887
O -0.561015 -2.416565 0.062607
O 4.671979 -0.726181 -0.361316
O -4.658061 -0.309684 -0.056948
O -3.544127 1.687052 -0.089187
N -0.139706 -1.228999 -0.118249
N -0.467504 1.103495 0.135617
N -2.435171 -0.416324 0.039897
C 1.127412 -0.701289 0.103030
C 0.938879 0.796517 0.175569
C 3.350052 1.054318 0.441807
C 1.981650 1.636570 0.246247
C 2.377950 -1.262283 -0.010845
C 3.526962 -0.421766 -0.034053
C -1.069942 -0.084418 0.059310
C -3.494752 0.483298 -0.042316
C -5.896282 0.438531 -0.115143
H 3.602141 1.088829 1.534349
H 1.902054 2.718698 0.205837
H 2.502476 -2.329382 -0.159913
H -2.624326 -1.443600 0.043911
H 4.984277 1.316651 -0.662396
H -5.914071 1.055669 -1.019488
H -5.990671 1.063052 0.779002
H -6.649110 -0.355276 -0.144041


%chk=000190206-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000190206

-1 1
O 4.510716 1.778650 -0.212927
O -0.713927 -2.306148 -0.034266
O 4.713377 -0.857539 -0.327449
O -4.636202 -0.405511 -0.080402
O -3.659331 1.737227 0.023945
N -0.197877 -1.041667 0.040756
N -0.435730 1.295365 0.100610
N -2.385421 -0.270741 -0.002854
C 1.094378 -0.571676 0.088896
C 0.953864 0.909382 0.132442
C 3.398883 1.047605 0.388082
C 2.059992 1.710231 0.176610
C 2.324016 -1.250158 -0.014888
C 3.511037 -0.461027 -0.025901
C -1.058944 0.119325 0.049446
C -3.529352 0.492121 -0.014666
C -5.944657 0.264694 -0.101910
H 3.549132 1.024464 1.500991
H 1.996045 2.802964 0.169605
H 2.364642 -2.323113 -0.217581
H -2.417055 -1.319713 -0.040884
H 5.136360 1.027453 -0.470990
H -6.032673 0.926865 -0.981528
H -6.091493 0.869786 0.810407
H -6.679180 -0.553240 -0.152142


