%chk=000219453.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219453

0 1
O -0.137212 -0.370600 -2.331358
C -0.179534 -0.162631 -0.893983
C 0.022346 -3.959159 -0.087623
C -0.273893 -1.499957 -0.173593
C 0.085707 -2.647977 -0.753935
C -1.077992 -4.318042 0.707862
C 1.078378 -4.870861 -0.262477
C -1.118274 -5.572478 1.322634
C 1.034601 -6.119860 0.360077
C -0.063235 -6.473788 1.152245
C 1.078923 0.503985 -0.582557
C -1.326343 0.681903 -0.564581
C 3.359379 1.691241 -0.046434
C -3.382164 2.217446 -0.004787
C 4.213812 2.077231 -1.096177
C -3.328927 3.593201 -0.297004
C 3.726651 1.941682 1.288746
C -4.535030 1.666990 0.585483
C 2.127952 1.049434 -0.338049
C -2.271211 1.387745 -0.306549
C 5.424925 2.708493 -0.805899
C -4.423927 4.406798 0.000995
C 4.940583 2.574000 1.565403
C -5.623304 2.491380 0.878585
C 5.789523 2.957453 0.521675
C -5.569746 3.858781 0.587551
H -0.627980 -1.436199 0.854708
H 0.467766 -2.659948 -1.783625
H -1.903184 -3.620739 0.840279
H 1.934925 -4.598892 -0.877642
H -1.974435 -5.847228 1.936588
H 1.857353 -6.820757 0.227361
H -0.095538 -7.448988 1.633759
H -1.026031 -0.622728 -2.662259
H 3.925864 1.881255 -2.128781
H -2.434416 4.016622 -0.753576
H 3.064129 1.641704 2.099299
H -4.574180 0.602449 0.811547
H 6.087319 3.007601 -1.617075
H -4.384371 5.471872 -0.224489
H 5.226442 2.768524 2.598118
H -6.516518 2.067335 1.335535
H 6.734857 3.449894 0.742660
H -6.421087 4.497514 0.818043


%chk=000219453-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000219453

0 1
O -0.055656 -0.405046 -2.437997
C -0.117880 -0.143821 -0.968418
C 0.004656 -3.986194 -0.043134
C -0.214476 -1.460629 -0.171472
C 0.055523 -2.675365 -0.720759
C -0.367821 -4.148912 1.322778
C 0.343634 -5.151018 -0.788211
C -0.397122 -5.426639 1.915377
C 0.315118 -6.431494 -0.195972
C -0.056203 -6.575777 1.160336
C 1.141680 0.553299 -0.625230
C -1.293745 0.706894 -0.656993
C 3.428245 1.762942 0.035079
C -3.441296 2.203703 -0.122118
C 4.349568 2.146817 -0.982909
C -3.405510 3.608925 -0.360739
C 3.749961 2.037136 1.396309
C -4.633158 1.621473 0.400130
C 2.197571 1.110617 -0.310527
C -2.291705 1.390893 -0.402939
C 5.558793 2.787131 -0.643460
C -4.534297 4.406531 -0.083253
C 4.961004 2.679137 1.726632
C -5.757699 2.426146 0.674572
C 5.870339 3.056687 0.710388
C -5.713592 3.820115 0.434600
H -0.495730 -1.334447 0.880889
H 0.354600 -2.686848 -1.778261
H -0.635573 -3.273222 1.924661
H 0.634737 -5.043719 -1.840565
H -0.685450 -5.531714 2.967491
H 0.581911 -7.313280 -0.789141
H -0.080157 -7.567830 1.624686
H -0.965836 -0.694958 -2.716119
H 4.104500 1.937031 -2.029280
H -2.490784 4.057866 -0.761559
H 3.045234 1.743386 2.181429
H -4.663871 0.542307 0.584233
H 6.259468 3.077136 -1.434303
H -4.496240 5.485276 -0.270437
H 5.197304 2.885056 2.776539
H -6.668877 1.968427 1.075211
H 6.810868 3.554807 0.970375
H -6.589130 4.442879 0.648778


