%chk=000188580.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000188580

0 1
O -1.583420 3.469221 0.737135
O 1.151002 3.924973 -0.792321
O -3.200086 -3.146825 0.092524
C -0.212608 0.243480 0.007973
C -1.178279 1.200270 -0.035726
C 1.205034 0.481564 0.002611
C -0.819494 2.642206 -0.149036
C 0.699345 2.935171 0.147127
C 1.674910 1.782757 0.011038
C -0.769984 -1.131806 0.029364
C -2.481314 0.508567 -0.024294
C 2.066517 -0.658672 -0.022571
C -2.221835 -0.918452 0.023830
C 1.519524 -1.995293 -0.005357
C 0.059815 -2.194111 0.024483
C 3.462747 -0.434328 -0.063584
C 3.083444 1.991272 -0.047355
C 3.943185 0.917350 -0.086602
C -3.768732 1.003157 -0.042684
C -3.307255 -1.782093 0.047310
C 2.399312 -3.061467 -0.024036
C 4.330096 -1.570181 -0.083694
C -4.846168 0.086156 -0.017634
C -4.635419 -1.282146 0.027470
C 3.804542 -2.840989 -0.063029
H -1.087276 3.046664 -1.159795
H 0.781891 3.363272 1.178123
H -0.299991 -3.220732 0.033899
H 3.454066 3.017954 -0.080829
H 5.020266 1.079367 -0.138595
H -3.956391 2.074652 -0.078310
H 2.034987 -4.087761 -0.011048
H -1.729650 3.023605 1.598641
H 5.406809 -1.410471 -0.116065
H 0.638830 4.755898 -0.671557
H -5.866324 0.474449 -0.034608
H -5.460736 -1.991319 0.046755
H 4.462854 -3.710166 -0.077796
H -2.251011 -3.442094 0.100141


%chk=000188580-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000188580

0 1
O -1.655041 3.662851 0.293213
O 1.177277 4.165568 -0.235958
O -3.211153 -3.183407 0.292586
C -0.200573 0.226533 0.088187
C -1.185726 1.199179 -0.009166
C 1.214663 0.459120 0.021482
C -0.760576 2.622298 -0.275015
C 0.680052 2.889572 0.269828
C 1.699902 1.784907 0.010626
C -0.777593 -1.118550 0.122520
C -2.485517 0.516272 -0.026382
C 2.087210 -0.666878 -0.038322
C -2.240570 -0.910820 0.093199
C 1.535447 -2.005788 -0.001848
C 0.085174 -2.205174 0.074318
C 3.505120 -0.442999 -0.135582
C 3.099274 2.004263 -0.092621
C 3.982125 0.911398 -0.174618
C -3.797600 1.020078 -0.132147
C -3.338253 -1.792348 0.145145
C 2.433650 -3.095010 -0.059442
C 4.372450 -1.585369 -0.193381
C -4.878837 0.098839 -0.109373
C -4.661375 -1.287332 0.035581
C 3.839492 -2.881341 -0.153534
H -0.784822 2.848933 -1.359794
H 0.561285 2.950489 1.384485
H -0.264579 -3.246239 0.043639
H 3.472691 3.032145 -0.114021
H 5.060379 1.087883 -0.264791
H -3.975294 2.093979 -0.239187
H 2.044994 -4.120231 -0.034606
H -1.841178 3.423545 1.238903
H 5.455567 -1.434517 -0.270142
H 0.447966 4.827800 -0.106219
H -5.906763 0.467298 -0.196640
H -5.494554 -1.995184 0.071797
H 4.509527 -3.746510 -0.197905
H -2.281037 -3.432154 0.517082


