%chk=000195603.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000195603

0 1
O -0.205477 -0.413437 0.439725
O 1.080502 3.143613 -1.174551
O 3.536455 2.251192 -0.900626
O -2.997339 0.504286 2.428546
O -2.139533 -0.499217 -2.188803
O 4.023724 -2.191491 0.982125
C -1.137026 0.721707 0.216484
C -0.702938 1.586184 -0.949271
C -2.469610 0.058757 0.091035
C 1.640532 0.996279 -0.307945
C 0.747473 2.034194 -0.827058
C 1.121779 -0.202689 0.249556
C 3.048293 1.096439 -0.381561
C -3.325984 -0.026084 1.214798
C -2.948421 -0.556804 -1.085347
C 1.938898 -1.256841 0.668536
C 3.329694 -1.100473 0.546193
C 3.911316 0.070975 0.035041
C -4.588832 -0.641991 1.173009
C -4.200277 -1.188620 -1.157863
C -5.011111 -1.221980 -0.019748
C 5.473479 -2.161038 0.922155
H -1.070708 1.298902 1.180005
H -0.806912 1.040206 -1.919652
H -1.371379 2.465399 -1.055804
H 1.511096 -2.168111 1.077920
H 4.981570 0.186523 -0.040612
H -5.202190 -0.661238 2.071081
H -4.535382 -1.648930 -2.080618
H -5.986637 -1.711020 -0.067920
H 4.530159 2.265185 -0.939789
H -2.067795 0.879420 2.446178
H -2.524198 -0.986513 -2.963804
H 5.732298 -3.148685 1.327428
H 5.806782 -2.061681 -0.114758
H 5.861300 -1.360720 1.558718


%chk=000195603-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000195603

0 1
O -0.193798 -0.626779 0.168210
O 1.041248 3.157050 -1.199428
O 3.601781 2.380961 -0.640740
O -3.031250 0.643489 2.441842
O -2.197990 -0.752210 -2.188323
O 4.185593 -2.252560 0.884720
C -1.130716 0.545835 0.137323
C -0.729778 1.509907 -0.988548
C -2.538014 -0.002723 0.085712
C 1.661377 0.969680 -0.303709
C 0.721337 1.987749 -0.835710
C 1.169282 -0.318670 0.112996
C 3.082328 1.141992 -0.265748
C -3.405531 0.070268 1.216281
C -3.053584 -0.645320 -1.076597
C 2.020953 -1.367687 0.496251
C 3.415752 -1.156875 0.489444
C 3.956481 0.099990 0.119952
C -4.727452 -0.433168 1.181277
C -4.366413 -1.162633 -1.126032
C -5.199425 -1.046948 0.008419
C 5.643637 -2.098113 0.915101
H -0.955938 1.086936 1.097881
H -0.841809 0.997738 -1.960536
H -1.388303 2.395304 -0.991444
H 1.606633 -2.327897 0.808750
H 5.037342 0.277617 0.129943
H -5.346001 -0.340873 2.077253
H -4.733923 -1.649049 -2.038090
H -6.219616 -1.442988 -0.024824
H 4.593067 2.360930 -0.609858
H -2.078235 0.910351 2.450915
H -2.633813 -1.268113 -2.910996
H 6.025799 -3.073035 1.250008
H 6.043301 -1.866566 -0.090906
H 5.949279 -1.311891 1.632014


