%chk=000219190.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219190

0 1
I 3.236875 -2.954305 1.779107
I 5.538401 1.269149 -1.922957
O -1.032126 2.154460 1.857948
O 5.360945 -1.105516 0.079687
O -0.335879 0.034920 1.982975
C -2.166851 1.539913 -0.667688
C -0.830732 1.028144 -0.200627
C -3.252354 0.520886 -0.428752
C 0.146995 0.671337 -1.047123
C 1.488133 0.187281 -0.694773
C -3.472628 -0.504183 -1.360341
C -4.044179 0.595490 0.726491
C 2.604050 0.795854 -1.304682
C 1.677835 -0.883821 0.195496
C -0.684433 0.953048 1.277644
C -4.482356 -1.444287 -1.137440
C -5.052434 -0.347465 0.943587
C 2.962730 -1.343367 0.468415
C 3.886595 0.347661 -1.022591
C 4.076829 -0.728936 -0.133279
C -5.274235 -1.367483 0.012824
H -2.397190 2.493820 -0.135031
H -2.132792 1.818735 -1.742408
H -0.023099 0.750336 -2.130246
H -2.856156 -0.572455 -2.253953
H -3.872552 1.385508 1.455944
H 2.454121 1.630299 -1.996965
H 0.806337 -1.349410 0.680954
H -4.651150 -2.239998 -1.861475
H -5.665409 -0.288022 1.841772
H -6.059380 -2.101020 0.184341
H -0.936232 2.134790 2.849299
H 5.430322 -1.881262 0.729948


%chk=000219190-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000219190

0 1
I 4.416528 -2.008781 2.233936
I 4.863653 0.240211 -3.481427
O -1.915443 1.122055 2.485767
O 5.633140 -1.201665 -0.737960
O -0.031610 -0.204348 2.443366
C -2.075492 1.596898 -0.154777
C -0.804384 0.933380 0.380132
C -3.272782 0.646750 -0.272307
C 0.260862 0.755147 -0.486392
C 1.622320 0.205060 -0.426813
C -3.138895 -0.620597 -0.895205
C -4.548132 1.037366 0.205498
C 2.412580 0.391397 -1.606174
C 2.218754 -0.491352 0.667737
C -0.828426 0.541065 1.809753
C -4.255549 -1.473409 -1.044269
C -5.667846 0.188169 0.057019
C 3.536626 -0.952328 0.565310
C 3.731499 -0.073773 -1.693062
C 4.331210 -0.760379 -0.602068
C -5.525800 -1.071318 -0.570117
H -2.357526 2.441029 0.498799
H -1.851841 2.020996 -1.153283
H 0.045096 1.156437 -1.489623
H -2.156009 -0.944429 -1.258644
H -4.661245 2.007796 0.703647
H 1.978196 0.917166 -2.462948
H 1.626907 -0.658555 1.570389
H -4.134992 -2.449643 -1.527784
H -6.647208 0.505869 0.432833
H -6.392422 -1.732129 -0.684336
H -1.900807 0.802802 3.428049
H 5.937038 -1.666783 0.091052


