%chk=000183209.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183209

0 1
O -2.837756 -0.838918 -2.297033
C -2.446097 0.125763 -0.061935
C -3.272560 -0.853712 -0.932374
C -2.955923 0.049844 1.394082
C -4.770478 -0.507768 -0.876155
C -4.452548 0.373447 1.476845
C -5.279045 -0.547430 0.568267
C -0.955309 -0.135032 -0.087623
C -0.049389 0.997374 0.126231
C 1.354376 0.756778 0.143722
C -0.454535 -1.385259 -0.270245
C 1.869894 -0.578123 -0.053268
C 0.969645 -1.656782 -0.265957
C 2.262435 1.832856 0.354226
C -0.506507 2.312399 0.315252
C 3.271752 -0.817746 -0.038184
C 1.478847 -2.951134 -0.463180
C 1.765208 3.131979 0.543010
C 3.689852 1.557669 0.367342
C 0.389382 3.363183 0.521221
C 4.168480 0.304421 0.181852
C 3.750500 -2.122764 -0.236040
C 2.857019 -3.175432 -0.447188
H -2.636595 1.160144 -0.451799
H -3.092653 -1.915657 -0.646030
H -2.378565 0.749343 2.028913
H -2.759549 -0.959015 1.806196
H -5.332561 -1.221946 -1.508276
H -4.952039 0.487138 -1.322327
H -4.626222 1.430328 1.197311
H -4.797787 0.276561 2.523822
H -5.241199 -1.585878 0.951610
H -6.344792 -0.251804 0.599599
H -1.116568 -2.236255 -0.444919
H -2.772412 0.068376 -2.646737
H -1.577183 2.521696 0.299093
H 0.795624 -3.781645 -0.632711
H 4.360921 2.400511 0.531808
H 2.453540 3.959530 0.705100
H 0.009577 4.373981 0.666082
H 5.238625 0.099016 0.191024
H 4.821689 -2.314818 -0.226406
H 3.240107 -4.183722 -0.602323


%chk=000183209-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000183209

0 1
O -2.880288 -1.189021 -2.256316
C -2.470069 0.091253 -0.117139
C -3.322235 -0.968875 -0.865242
C -2.985010 0.192127 1.358212
C -4.821865 -0.604170 -0.820486
C -4.487545 0.545735 1.426659
C -5.336816 -0.473178 0.632610
C -0.956583 -0.137825 -0.149169
C -0.051170 0.981000 0.131091
C 1.376486 0.743379 0.167042
C -0.418303 -1.391836 -0.397072
C 1.903633 -0.570881 -0.075472
C 1.001059 -1.654053 -0.367094
C 2.288292 1.830194 0.443301
C -0.513074 2.308384 0.364521
C 3.325887 -0.811795 -0.040393
C 1.530147 -2.949001 -0.619433
C 1.773330 3.133519 0.672149
C 3.711413 1.563428 0.477804
C 0.384710 3.364933 0.627619
C 4.211729 0.295569 0.247174
C 3.813715 -2.122551 -0.293360
C 2.921907 -3.178099 -0.580339
H -2.690006 1.066758 -0.608495
H -3.183685 -1.960559 -0.393957
H -2.385837 0.938234 1.911230
H -2.806470 -0.783295 1.855205
H -5.386309 -1.377242 -1.373855
H -4.975239 0.357131 -1.356385
H -4.645959 1.561208 1.006941
H -4.817167 0.581729 2.482856
H -5.280154 -1.462820 1.130876
H -6.402844 -0.176077 0.632447
H -1.077798 -2.226037 -0.653129
H -2.816730 -0.310949 -2.711550
H -1.584559 2.527588 0.337098
H 0.842912 -3.771619 -0.848332
H 4.389262 2.398349 0.691626
H 2.466718 3.956545 0.880851
H -0.005397 4.374262 0.799197
H 5.291721 0.108416 0.275410
H 4.894280 -2.306010 -0.266633
H 3.313114 -4.182349 -0.776174


