%chk=000188011.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000188011

0 1
O 0.031464 1.643667 1.526354
O -0.663934 3.457470 -0.665733
O 1.682268 2.241108 -1.446198
O -2.409330 2.428793 1.113351
C 0.123714 1.242815 0.158037
C -0.870251 2.045263 -0.739090
C -0.236888 -0.228281 0.055089
C 1.603252 1.607604 -0.157299
C -2.314345 1.870266 -0.215704
C -1.631605 -0.577871 0.011301
C -2.672488 0.409809 -0.080876
C 0.736745 -1.210438 0.070792
C 2.585860 0.471654 -0.068927
C 2.173145 -0.866500 0.068110
C -2.004987 -1.944899 0.052519
C 0.338771 -2.588600 0.077646
C -3.996831 0.036282 -0.061083
C -0.981650 -2.944945 0.083217
C 3.952622 0.790237 -0.115122
C 3.159675 -1.865434 0.186514
C -3.388990 -2.305981 0.062825
C -4.359852 -1.337477 0.019536
C 4.916212 -0.211728 -0.010379
C 4.514983 -1.543494 0.148583
H -0.776294 1.723873 -1.800121
H 1.895765 2.442865 0.540140
H -3.030648 2.429938 -0.861054
H -0.918821 1.575316 1.857840
H 1.115419 -3.357151 0.090156
H -4.788353 0.786270 -0.102398
H -1.276954 -3.994095 0.108814
H 0.259324 3.675050 -0.966207
H 4.257752 1.831421 -0.235233
H 1.709430 1.574606 -2.165415
H 2.861127 -2.908308 0.312540
H -3.653562 -3.361984 0.110094
H -1.961625 3.322481 1.111398
H -5.417062 -1.599846 0.041395
H 5.974863 0.040456 -0.045620
H 5.263684 -2.329313 0.243710


%chk=000188011-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000188011

0 1
O 0.099276 1.566469 1.610419
O -0.606858 3.496527 -0.635470
O 1.652408 2.155044 -1.627742
O -2.412578 2.524173 1.218663
C 0.132921 1.225783 0.169681
C -0.882606 2.062302 -0.664485
C -0.239345 -0.247943 0.018694
C 1.585437 1.586846 -0.243414
C -2.309976 1.884427 -0.133061
C -1.642250 -0.587544 0.001259
C -2.675968 0.419219 -0.022342
C 0.749080 -1.252239 0.007172
C 2.595766 0.474503 -0.071477
C 2.192894 -0.890137 0.037689
C -2.036776 -1.978625 0.019584
C 0.330875 -2.629797 -0.015988
C -4.023285 0.043287 0.005308
C -1.012915 -2.981417 0.002814
C 3.967177 0.820789 -0.040250
C 3.213228 -1.873544 0.181445
C -3.424991 -2.324648 0.050949
C -4.405862 -1.330110 0.055573
C 4.964139 -0.166463 0.090139
C 4.576738 -1.522463 0.204503
H -0.846770 1.685711 -1.707344
H 1.855033 2.446578 0.391153
H -3.015911 2.411200 -0.804760
H -0.852057 1.807034 1.834797
H 1.079977 -3.425510 -0.047421
H -4.794862 0.821379 -0.012597
H -1.307666 -4.037326 0.001633
H 0.244494 3.626326 -1.133378
H 4.244566 1.877934 -0.122895
H 1.778092 1.419514 -2.279381
H 2.949317 -2.928892 0.293665
H -3.705950 -3.384260 0.070440
H -2.104741 3.463906 1.090593
H -5.467401 -1.597170 0.084754
H 6.022572 0.113452 0.114161
H 5.336381 -2.303418 0.320419


