%chk=000190479.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000190479

0 1
O -3.109029 -2.270221 -0.686582
O -5.323332 -1.813455 1.137769
C -0.255754 1.014150 -0.057135
C 1.191202 0.891722 -0.017543
C -1.062288 -0.155897 -0.097349
C 1.786949 -0.377600 -0.025864
C -2.482366 -0.023668 -0.112691
C 3.231387 -0.503423 0.015794
C -0.412134 -1.442326 -0.111913
C -3.075046 1.241304 -0.106510
C 0.943536 -1.544749 -0.077699
C 4.027122 0.666561 0.064699
C -0.890399 2.286024 -0.061772
C 2.030521 2.061682 0.032179
C -2.263568 2.402519 -0.091091
C 3.387536 1.956268 0.071648
C -3.379530 -1.215095 -0.172921
C 3.884244 -1.771442 0.009443
C -4.542012 1.387845 -0.108023
C 5.447632 0.555211 0.106352
C -4.786970 -0.982621 0.454374
C -5.354672 0.352624 0.142836
C 5.257704 -1.858929 0.050117
C 6.050257 -0.682454 0.099240
H -1.035732 -2.342478 -0.166670
H 1.423712 -2.527394 -0.091222
H -0.268847 3.186778 -0.042813
H 1.551449 3.042883 0.037757
H -2.732800 3.386173 -0.097131
H 4.018925 2.844129 0.109338
H 3.276689 -2.677661 -0.028590
H -4.934063 2.388549 -0.309773
H 6.045942 1.464608 0.143783
H -6.441598 0.428284 0.173914
H 5.752380 -2.829458 0.045072
H 7.134854 -0.775444 0.130876


%chk=000190479-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000190479

0 1
O -3.074588 -2.445398 0.037188
O -5.788140 -1.964529 0.037829
C -0.248612 1.010034 0.003327
C 1.210940 0.899852 0.002127
C -1.078982 -0.183233 0.015443
C 1.827005 -0.393740 0.013086
C -2.525060 -0.057739 0.016414
C 3.282676 -0.518276 0.011714
C -0.411496 -1.460977 0.026657
C -3.115606 1.241754 0.005860
C 0.972034 -1.550404 0.025497
C 4.090052 0.678612 -0.000440
C -0.893413 2.283124 -0.007314
C 2.058024 2.068197 -0.009785
C -2.284240 2.396823 -0.005970
C 3.438722 1.961521 -0.010952
C -3.447217 -1.235393 0.027893
C 3.959066 -1.779977 0.021867
C -4.567458 1.442232 0.006656
C 5.516691 0.579780 -0.001967
C -4.996908 -0.977741 0.028270
C -5.469279 0.412156 0.017310
C 5.357136 -1.855483 0.020149
C 6.147078 -0.667840 0.008163
H -1.020532 -2.364920 0.036046
H 1.417410 -2.549075 0.034677
H -0.299298 3.199896 -0.016736
H 1.615693 3.067544 -0.018171
H -2.751920 3.387671 -0.014159
H 4.060338 2.864555 -0.020041
H 3.386719 -2.711707 0.031124
H -4.921572 2.480766 -0.001686
H 6.109565 1.501890 -0.011276
H -6.551798 0.575324 0.018068
H 5.848876 -2.834225 0.028081
H 7.239995 -0.738075 0.006949


