%chk=000193557.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000193557

0 1
O -0.824720 1.919329 -0.261048
O 2.665561 1.740623 -0.368720
O -1.254910 -0.235542 0.242665
O 0.997641 3.735862 1.898247
O -3.825938 2.230233 -0.611021
O -4.653390 -0.228672 -2.001739
O -2.472771 -1.833084 -1.821225
O 1.619586 -0.393134 1.666469
O 3.662988 -1.759286 0.770536
O 2.675794 -1.798573 -1.349792
O -0.579385 -2.545394 1.930763
C 0.413117 1.819981 0.486994
C 1.420168 0.997561 -0.342431
C 1.009471 3.246295 0.554179
C -1.870217 1.065553 0.200744
C -2.966305 1.116084 -0.887919
C -3.912657 -0.106373 -0.789733
C -3.153660 -1.451698 -0.638592
C -2.154664 -1.332950 0.537506
C 1.678569 -0.405635 0.238882
C 2.495186 3.062809 0.204143
C 3.034609 -0.982184 -0.237172
C -1.197087 -2.532447 0.646426
C 2.980498 -2.970017 1.176535
C 3.789817 -2.246206 -2.153269
H 0.239396 1.386680 1.498845
H 1.101810 0.915579 -1.408646
H 0.471111 3.953135 -0.109755
H -2.209376 1.360370 1.211900
H -2.525891 1.215381 -1.904929
H -4.625340 0.045744 0.056663
H -3.882270 -2.287358 -0.501430
H -2.662026 -1.139400 1.507315
H 0.823642 -1.078180 -0.049765
H 3.136223 3.100750 1.105493
H 2.861736 3.759305 -0.565903
H 3.810417 -0.222219 -0.477929
H -0.423418 -2.492736 -0.148621
H -1.738622 -3.496144 0.598463
H 0.096338 4.022366 2.153115
H -3.381540 3.070004 -0.865604
H -5.213160 0.575443 -2.126196
H -1.796226 -1.157338 -2.065730
H 2.520241 -0.239233 2.051325
H 0.026212 -1.757364 2.027706
H 2.085132 -2.715548 1.755746
H 3.731287 -3.469154 1.797588
H 2.722971 -3.570024 0.298473
H 4.532947 -2.748451 -1.525365
H 4.225631 -1.396317 -2.686289
H 3.318273 -2.949528 -2.849401


%chk=000193557-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000193557

0 1
O -0.710859 1.723110 -0.649669
O 2.908535 1.788669 0.021115
O -1.274952 -0.446934 0.062699
O 0.342158 4.113316 1.189786
O -3.626023 2.280681 -1.023044
O -5.207328 -0.075644 -1.317021
O -3.065755 -2.092322 -1.445745
O 1.532409 -0.512416 1.580822
O 3.528680 -2.137759 0.767990
O 3.229150 -1.398059 -1.535032
O -0.488115 -2.370523 2.085585
C 0.501686 1.808494 0.193819
C 1.695646 1.005036 -0.372602
C 1.023394 3.257325 0.224040
C -1.758341 0.939816 -0.059853
C -2.985630 0.959161 -0.983281
C -4.058119 -0.005869 -0.429779
C -3.484190 -1.430876 -0.208228
C -2.282646 -1.306205 0.761509
C 1.811249 -0.441512 0.132807
C 2.481371 3.059130 0.662613
C 3.219030 -1.023389 -0.144275
C -1.536640 -2.600023 1.100659
C 2.699612 -3.355539 0.572120
C 4.586507 -1.586287 -2.079589
H 0.276252 1.474996 1.224305
H 1.648026 0.979214 -1.478889
H 0.963522 3.678086 -0.801719
H -2.014109 1.317816 0.958663
H -2.672861 0.643526 -1.999746
H -4.365662 0.390553 0.567486
H -4.278911 -2.075621 0.204012
H -2.583795 -0.806087 1.707346
H 1.050881 -1.047241 -0.391360
H 2.529688 2.971589 1.765203
H 3.161239 3.853763 0.318155
H 4.007499 -0.284930 0.092773
H -1.141827 -3.048830 0.165011
H -2.236928 -3.320780 1.558000
H -0.580062 4.284251 0.871500
H -3.040575 2.902032 -1.523919
H -5.479804 0.858941 -1.513453
H -2.206889 -1.677391 -1.726790
H 2.312903 -0.964962 2.006989
H 0.107789 -1.598476 1.823772
H 1.674125 -3.213898 0.964340
H 3.208069 -4.140465 1.151955
H 2.667678 -3.628472 -0.497005
H 5.123658 -2.384449 -1.534705
H 5.162737 -0.642517 -2.017842
H 4.449327 -1.873135 -3.133035


