%chk=000193713.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000193713

0 1
O -0.734461 -1.346737 0.792483
O -0.639560 1.521632 0.920575
O 1.236442 0.140700 2.272460
O -1.675996 0.446954 -2.323595
O 2.508584 0.174681 -1.076713
O -2.757291 -1.625861 -1.105820
C 0.263124 -0.567578 0.088991
C -0.436494 0.754576 -0.289403
C 1.507430 -0.413318 0.992485
C -1.839446 0.549387 -0.911364
C 2.578109 0.486919 0.333724
C -2.559765 -0.689280 -0.356456
C -0.591469 -2.778876 0.643264
C -0.382502 2.934686 0.782337
C 3.606879 0.703116 -1.842165
H 0.560133 -1.086478 -0.858841
H 0.212856 1.303771 -1.016059
H 1.927749 -1.419282 1.231941
H -2.456362 1.467110 -0.760583
H 3.582167 0.267626 0.731224
H 2.354633 1.557066 0.479559
H 0.431130 0.732782 2.238519
H -2.906161 -0.639707 0.682047
H -0.887401 -3.070692 -0.372267
H 0.422407 -3.100802 0.887337
H -1.308018 -3.163986 1.380436
H -1.795223 -0.503083 -2.610981
H -1.026152 3.370132 0.012232
H 0.674765 3.110953 0.563132
H -0.647751 3.322670 1.774540
H 3.632649 1.794353 -1.778242
H 3.362742 0.378882 -2.862195
H 4.552353 0.262886 -1.511905


%chk=000193713-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000193713

0 1
O -0.728717 -1.389232 0.710912
O -0.625129 1.526204 1.032021
O 1.322511 0.067475 2.246514
O -1.629647 0.073231 -2.256569
O 2.855827 -0.071757 -1.136791
O -3.300223 -1.378234 -0.762172
C 0.273915 -0.544420 0.042921
C -0.444559 0.785077 -0.239521
C 1.564605 -0.430561 0.894623
C -1.827504 0.541455 -0.897022
C 2.630448 0.452988 0.213522
C -2.701069 -0.461632 -0.125567
C -0.565016 -2.831959 0.514003
C -0.645238 2.984947 0.868312
C 3.946418 0.610023 -1.830457
H 0.541374 -0.980199 -0.941177
H 0.168772 1.385111 -0.942368
H 1.984693 -1.447428 1.009201
H -2.378514 1.510321 -0.904860
H 3.561791 0.412525 0.816685
H 2.295306 1.514636 0.172512
H 0.538396 0.687095 2.179646
H -2.896182 -0.242891 0.942121
H -0.301740 -3.062985 -0.537354
H 0.210318 -3.230331 1.194635
H -1.541070 -3.282293 0.754208
H -2.250500 -0.708826 -2.361703
H -1.476541 3.306079 0.211315
H 0.314104 3.351460 0.449531
H -0.795474 3.403400 1.875436
H 3.735640 1.694018 -1.953140
H 4.025926 0.139352 -2.822779
H 4.907179 0.492552 -1.285943


