%chk=000110354.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000110354

0 1
O -0.730063 1.013966 0.135100
O 3.822740 2.251780 0.774788
O 2.951775 -3.679828 -1.006281
O -4.187740 0.664200 2.351968
C 2.801585 0.222262 0.104305
C 1.601178 -1.793402 -0.523281
C 0.408883 0.237765 -0.071582
C 2.804560 -1.137084 -0.259513
C 1.602245 0.926700 0.199265
C 0.376264 -1.110028 -0.431045
C -1.922821 0.672346 -0.514078
C 4.123038 0.890474 0.377858
C 1.570641 -3.250595 -0.904326
C -3.081672 0.786028 0.278281
C -2.969067 1.149744 1.729107
C -1.970515 0.355942 -1.874467
C -4.318646 0.563950 -0.338097
C -3.220316 0.137359 -2.460854
C -4.387441 0.237263 -1.696785
C 5.000749 3.031597 1.045825
C 3.084024 -5.072796 -1.340872
C -4.227101 0.904139 3.769404
H 3.740833 -1.692681 -0.340100
H 1.587968 1.982245 0.478659
H -0.566098 -1.615911 -0.619604
H 4.756584 0.910126 -0.529681
H 4.665005 0.388656 1.202234
H 1.076631 -3.402960 -1.882708
H 1.061383 -3.855365 -0.129508
H -2.093685 0.667060 2.205546
H -2.907989 2.246568 1.863998
H -1.055101 0.292791 -2.458935
H -5.228017 0.638296 0.265258
H -3.281765 -0.108436 -3.520321
H -5.356587 0.062695 -2.160010
H 5.565810 2.604774 1.879350
H 4.578018 4.005774 1.323965
H 5.620798 3.122837 0.149400
H 4.173122 -5.204707 -1.373477
H 2.642783 -5.702358 -0.562744
H 2.641523 -5.280660 -2.319343
H -5.194885 0.474338 4.056571
H -4.202083 1.976980 3.981427
H -3.408649 0.381356 4.273300


%chk=000110354-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000110354

0 1
O -0.801295 0.762603 0.388657
O 3.844774 2.339752 0.759444
O 3.143897 -3.754771 -1.112548
O -4.507505 0.982303 2.373843
C 2.844545 0.217547 0.104535
C 1.716851 -1.863464 -0.545728
C 0.416769 0.101947 0.073272
C 2.903521 -1.133325 -0.323371
C 1.596003 0.841613 0.301858
C 0.458538 -1.244472 -0.343100
C -1.984265 0.533071 -0.364360
C 4.140957 0.972452 0.341458
C 1.755828 -3.315256 -0.994588
C -3.196345 0.679611 0.357285
C -3.145339 0.981720 1.841327
C -1.975166 0.278030 -1.753142
C -4.414966 0.548838 -0.344945
C -3.205405 0.148618 -2.435730
C -4.425246 0.280239 -1.733447
C 5.057019 3.114323 1.003811
C 3.243244 -5.149225 -1.531912
C -4.532155 1.297764 3.798135
H 3.862165 -1.635941 -0.484376
H 1.543299 1.881362 0.630480
H -0.472098 -1.802708 -0.496868
H 4.750697 0.982045 -0.591554
H 4.742955 0.456151 1.124699
H 1.238005 -3.426700 -1.975450
H 1.215619 -3.956457 -0.260207
H -2.520836 0.224297 2.365635
H -2.662863 1.970320 2.013501
H -1.025256 0.195334 -2.289909
H -5.344728 0.657670 0.219575
H -3.205167 -0.045243 -3.514141
H -5.378784 0.179847 -2.262955
H 5.671091 2.666625 1.814752
H 4.725656 4.118883 1.309488
H 5.681191 3.195870 0.087893
H 4.318504 -5.379886 -1.587184
H 2.758021 -5.830877 -0.800596
H 2.781166 -5.309887 -2.529718
H -5.590003 1.271280 4.103297
H -4.115863 2.308266 3.999496
H -3.959130 0.553032 4.391388


