%chk=000219593.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219593

0 1
O -0.777884 1.666654 0.648476
O 0.505850 0.092609 -1.670974
C -1.938174 -0.310153 -0.036977
C -0.576443 0.252062 0.490837
C 1.990810 -0.242626 0.195581
C 0.617124 0.047959 -0.470975
C -2.969267 -0.177264 1.097740
C -1.742661 -1.792339 -0.397871
C -2.399664 0.486978 -1.260649
C 1.891305 -1.609199 0.889311
C 2.320223 0.863970 1.206849
C 3.068394 -0.283763 -0.895650
H -0.349955 -0.189136 1.487356
H -3.028944 0.865081 1.439999
H -2.721737 -0.799647 1.961032
H -3.969126 -0.466563 0.758824
H -1.346924 -2.376495 0.436433
H -1.064674 -1.910263 -1.252726
H -2.696298 -2.247128 -0.690134
H -2.477865 1.556108 -1.019649
H -1.674614 0.406422 -2.084731
H -3.369718 0.146962 -1.628848
H 1.614905 -2.400018 0.181244
H 2.855554 -1.895342 1.326845
H 1.155676 -1.614144 1.700492
H 1.633451 0.876214 2.058552
H 3.327421 0.719885 1.620445
H 2.314929 1.854153 0.735964
H 3.152272 0.680580 -1.412248
H 4.051218 -0.534954 -0.487441
H 2.823587 -1.024000 -1.669139
H -0.023171 2.061996 1.131134


%chk=000219593-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000219593

0 1
O -0.711241 1.737703 0.555674
O 0.530489 -0.018616 -1.753452
C -1.959223 -0.288225 -0.053534
C -0.583073 0.263801 0.423195
C 2.017642 -0.242502 0.181195
C 0.639521 -0.001176 -0.499831
C -2.966360 -0.083850 1.112538
C -1.816778 -1.805914 -0.347406
C -2.481023 0.454922 -1.311237
C 1.969411 -1.670027 0.814299
C 2.300101 0.804863 1.295460
C 3.142403 -0.184808 -0.879169
H -0.377728 -0.178374 1.422237
H -3.034972 0.983948 1.383307
H -2.666476 -0.656344 2.012420
H -3.971078 -0.432717 0.810409
H -1.408019 -2.355388 0.524131
H -1.162873 -1.988330 -1.217901
H -2.810112 -2.235164 -0.573465
H -2.549019 1.538967 -1.117991
H -1.810980 0.299069 -2.171210
H -3.490178 0.080272 -1.568274
H 1.763937 -2.436892 0.046173
H 2.948967 -1.897864 1.273936
H 1.198516 -1.753322 1.602385
H 1.546949 0.776418 2.105909
H 3.279004 0.587810 1.761803
H 2.353362 1.829289 0.880921
H 3.191719 0.812331 -1.351552
H 4.118992 -0.399990 -0.407243
H 2.966574 -0.917987 -1.683798
H 0.027144 2.082695 1.119170


