%chk=000291929.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291929

0 1
O 1.113392 0.928737 1.864512
O 6.836337 -0.356241 -1.821266
O 4.980192 0.310365 -2.713371
N -0.708895 -0.247577 0.149832
N 0.637936 -0.517032 0.099242
N 5.643642 -0.108206 -1.779521
C -7.114744 1.367654 0.704658
C -5.639422 1.534064 1.150463
C -7.139109 0.314873 -0.433487
C -4.855754 0.592926 0.280398
C -5.707163 -0.098531 -0.618167
C -3.489267 0.365155 0.282926
C -5.185897 -1.020012 -1.515600
C -2.956684 -0.572478 -0.629947
C -3.801979 -1.254979 -1.517985
C -1.508830 -0.861186 -0.679567
C 2.930950 -0.234455 0.824890
C 1.488799 0.156611 1.018786
C 3.585291 0.002172 -0.385426
C 4.941082 -0.341921 -0.496115
C 3.623706 -0.785501 1.914727
C 5.644322 -0.900570 0.582566
C 4.975418 -1.120344 1.788429
H -7.527028 2.328197 0.355936
H -7.742843 1.042744 1.549686
H -5.510485 1.291192 2.220683
H -5.294241 2.576296 1.024706
H -7.557310 0.738188 -1.364331
H -7.775139 -0.548890 -0.169380
H -2.828077 0.894386 0.972056
H -5.831149 -1.554240 -2.208148
H -3.391468 -1.976659 -2.221447
H -1.206033 -1.597484 -1.440198
H 1.028173 -1.191570 -0.569520
H 3.066128 0.456769 -1.238530
H 3.102972 -0.943050 2.864802
H 6.705286 -1.153961 0.469060
H 5.512392 -1.548443 2.637248


%chk=000291929-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000291929

0 1
O 1.163554 0.539061 2.274785
O 6.732280 -1.053080 -2.018158
O 4.644975 -0.770352 -2.892942
N -0.701316 -0.125420 0.281385
N 0.656774 -0.384623 0.174345
N 5.465484 -0.842430 -1.897326
C -7.283721 1.146897 0.791625
C -5.826128 1.253804 1.362489
C -7.195915 0.361767 -0.563912
C -4.948454 0.542396 0.344248
C -5.721304 0.040842 -0.739033
C -3.557540 0.354050 0.380496
C -5.096239 -0.655845 -1.795741
C -2.918092 -0.348751 -0.682994
C -3.698213 -0.848328 -1.764661
C -1.469803 -0.572441 -0.692174
C 2.993504 -0.279578 0.912620
C 1.535183 0.008216 1.193298
C 3.530345 -0.437933 -0.386475
C 4.912773 -0.678333 -0.527773
C 3.862455 -0.341774 2.034627
C 5.785477 -0.760092 0.577761
C 5.241982 -0.584512 1.867997
H -7.715392 2.150218 0.633640
H -7.944107 0.622461 1.503524
H -5.741963 0.781175 2.359269
H -5.513572 2.307383 1.490332
H -7.576877 0.964448 -1.410751
H -7.805492 -0.562079 -0.541791
H -2.943294 0.731670 1.204852
H -5.686079 -1.044880 -2.633620
H -3.202559 -1.388165 -2.581668
H -1.059901 -1.132559 -1.559301
H 1.020283 -0.917815 -0.630046
H 2.931937 -0.344385 -1.298046
H 3.427012 -0.183071 3.026441
H 6.849836 -0.946460 0.412799
H 5.896607 -0.634481 2.743472


