%chk=000291357.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291357

0 1
O 1.979718 -3.093240 2.714073
O -0.025836 2.718851 -0.604051
O -0.117251 -2.608489 2.896496
O -0.879573 2.177698 1.305801
O 4.570312 -1.415282 -0.939608
O 3.989494 0.428877 -1.918149
N -2.450463 -0.347311 0.911287
N -1.197666 -0.864225 1.305945
N 0.997462 -2.455738 2.392245
N -0.200612 1.943163 0.316964
N 3.815346 -0.476121 -1.121122
C 0.075202 -0.504116 1.018995
C 1.139680 -1.449613 1.345798
C 0.503098 0.657990 0.267395
C -2.520670 0.146241 -0.457951
C 2.347302 -1.426183 0.646250
C 1.690939 0.638247 -0.458281
C 2.588945 -0.435537 -0.315868
C -3.075452 0.501732 1.968408
C -3.030157 1.413608 -0.783690
C -2.178980 -0.764153 -1.477680
C -3.204948 1.760907 -2.125976
C -2.351825 -0.398012 -2.812947
C -2.865323 0.861648 -3.140836
H -1.356420 -1.690778 1.959160
H 3.122907 -2.190114 0.851883
H 1.954068 1.484286 -1.122966
H -2.631039 1.505735 2.098707
H -4.144606 0.617316 1.710796
H -3.030422 -0.016380 2.942100
H -3.278492 2.139312 -0.008052
H -1.798870 -1.754775 -1.229672
H -3.599109 2.746355 -2.379202
H -2.088027 -1.100730 -3.604291
H -2.997335 1.141933 -4.185662


%chk=000291357-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000291357

0 1
O 1.655747 -3.617569 2.180390
O 0.182748 2.769139 -0.831673
O -0.309931 -2.626145 2.773792
O -0.793937 2.266801 1.174714
O 4.820789 -1.519694 -0.705364
O 4.346573 0.476981 -1.718200
N -2.277154 0.063842 0.991402
N -1.138580 -0.602371 1.420834
N 0.824083 -2.639231 2.098119
N -0.044009 1.974053 0.158854
N 4.050711 -0.507046 -0.933561
C 0.155959 -0.432325 0.992960
C 1.122886 -1.504207 1.223239
C 0.652620 0.672848 0.194331
C -2.514151 0.298694 -0.393202
C 2.382636 -1.520635 0.603916
C 1.892054 0.635739 -0.449646
C 2.741577 -0.473494 -0.258518
C -3.144769 0.580670 2.064549
C -3.331654 1.391465 -0.788781
C -1.980983 -0.574459 -1.382203
C -3.621089 1.593186 -2.153143
C -2.268316 -0.350430 -2.743249
C -3.090360 0.730277 -3.139583
H -1.252499 -1.389431 2.101347
H 3.068830 -2.351366 0.789908
H 2.214471 1.484648 -1.059144
H -2.842076 1.594238 2.381465
H -4.188512 0.588144 1.712618
H -3.076804 -0.095495 2.935542
H -3.704349 2.099003 -0.042943
H -1.373426 -1.436761 -1.090271
H -4.245453 2.443574 -2.447124
H -1.855400 -1.030334 -3.496249
H -3.306833 0.900794 -4.198828


