%chk=000191622.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191622

0 1
O 2.406000 -1.583021 -1.102964
O 1.845965 -1.623753 1.062282
C 3.127631 1.304375 0.528279
C 1.912197 1.582851 -0.365993
C 4.363842 0.928316 -0.297683
C 0.626179 1.705409 0.466528
C 5.578742 0.649333 0.596618
C -4.140303 2.625730 -0.393874
C -2.835748 2.411635 -1.176765
C -2.256599 -2.426887 -0.473609
C -4.324958 1.626181 0.758508
C -0.598139 1.646988 -0.396199
C -3.476681 -2.163709 0.426162
C -0.935352 -2.106295 0.234368
C -1.612225 2.513636 -0.313752
C -4.300721 0.199239 0.294418
C -3.538330 -0.732778 0.873686
C 6.800797 0.236008 -0.219489
C 0.272431 -2.454804 -0.643606
C 1.529688 -1.863570 -0.079842
H 3.343676 2.188513 1.156921
H 2.889126 0.482946 1.240248
H 2.069097 2.508751 -0.950759
H 1.798428 0.773555 -1.115658
H 4.143747 0.026965 -0.920189
H 4.600616 1.732479 -1.020516
H 0.577372 0.875714 1.207910
H 0.657483 2.634404 1.068795
H 5.816262 1.550411 1.196204
H 5.332848 -0.142125 1.332728
H -4.995996 2.553135 -1.093142
H -4.167725 3.654917 0.014328
H -2.765557 3.166279 -1.988607
H -2.875746 1.426370 -1.686604
H -2.345348 -1.817315 -1.394829
H -2.267983 -3.484240 -0.800914
H -3.540797 1.805223 1.523787
H -5.290951 1.824545 1.268572
H -0.615654 0.816418 -1.103644
H -4.397741 -2.448790 -0.121790
H -3.443423 -2.829554 1.312854
H -0.868100 -2.648901 1.198428
H -0.908068 -1.027404 0.501000
H -1.607964 3.348001 0.385939
H -4.948424 -0.022684 -0.552282
H -2.887832 -0.494661 1.716233
H 6.618924 -0.682781 -0.787990
H 7.090723 1.013241 -0.935901
H 7.664766 0.051799 0.429617
H 0.123234 -2.097929 -1.687137
H 0.393995 -3.556517 -0.727963
H 3.254294 -1.118952 -0.783110


%chk=000191622-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000191622

0 1
O 2.802098 -2.665264 -0.541803
O 1.754461 -1.943799 1.398739
C 3.107070 1.368633 0.485681
C 1.813113 1.512407 -0.345734
C 4.337000 0.983415 -0.367524
C 0.567533 1.841317 0.519486
C 5.621952 0.780576 0.468144
C -4.243016 2.780194 -0.269585
C -2.955354 2.658853 -1.133546
C -2.160693 -2.434921 -0.632639
C -4.374228 1.691020 0.831258
C -0.725134 1.792940 -0.267035
C -3.475363 -2.114673 0.138733
C -0.887462 -2.296324 0.232058
C -1.669571 2.767633 -0.336834
C -4.380173 0.275317 0.288318
C -3.520301 -0.700525 0.682598
C 6.845832 0.389540 -0.388614
C 0.391098 -2.631280 -0.559326
C 1.661559 -2.372187 0.227165
H 3.312558 2.320380 1.018924
H 2.946907 0.598118 1.267891
H 1.941622 2.295548 -1.120030
H 1.629808 0.563544 -0.893890
H 4.113264 0.051921 -0.931565
H 4.518923 1.766613 -1.132917
H 0.525272 1.096927 1.344367
H 0.689577 2.834673 0.994757
H 5.843257 1.713703 1.025210
H 5.438110 0.001951 1.237524
H -5.124496 2.732666 -0.941578
H -4.269580 3.777638 0.214555
H -2.984774 3.456857 -1.905125
H -2.967475 1.691275 -1.671524
H -2.087888 -1.757544 -1.508286
H -2.225425 -3.468351 -1.032360
H -3.543061 1.798292 1.554201
H -5.314681 1.881598 1.390389
H -0.905281 0.859367 -0.827547
H -4.338542 -2.281640 -0.534666
H -3.573682 -2.840124 0.973986
H -0.959229 -2.955737 1.118552
H -0.804370 -1.265768 0.621532
H -1.514978 3.705597 0.222381
H -5.135315 0.047025 -0.482833
H -2.775182 -0.447876 1.452955
H 6.662608 -0.552842 -0.939753
H 7.069982 1.172934 -1.136972
H 7.749099 0.247514 0.233008
H 0.447592 -2.032923 -1.490700
H 0.400156 -3.689357 -0.887392
H 3.616501 -2.468154 -0.003033


