%chk=000181052.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000181052

0 1
O -1.459732 0.100986 -1.630487
O -1.253291 -2.893214 0.443928
O 1.199029 -1.405143 -1.510969
O 0.441350 -3.013431 1.939260
C -2.144688 0.744325 0.616213
C -2.523070 0.752083 -0.880980
C -2.032098 -0.709887 1.094096
C -3.184869 1.552796 1.406242
C -2.574478 2.173768 -1.447040
C -1.022357 -1.457699 0.223903
C -1.266674 -1.291025 -1.291255
C -3.273232 2.986117 0.859933
C -3.580054 3.010350 -0.645331
C -0.051670 -1.707496 -2.142117
C -0.434410 -3.560307 1.315900
C 1.565059 0.003972 -1.551445
C 2.543577 0.213012 -0.428717
C 2.435845 -0.521891 0.759951
C 3.558793 1.171648 -0.566812
C 3.338291 -0.302817 1.802978
C 4.454614 1.392197 0.483015
C 4.347493 0.656173 1.667687
H -1.144162 1.233684 0.729186
H -3.466486 0.198657 -1.070872
H -1.715902 -0.748108 2.154718
H -3.014712 -1.219842 1.059322
H -4.176048 1.064383 1.352404
H -2.914250 1.573663 2.478516
H -1.565559 2.629365 -1.410426
H -2.848292 2.146285 -2.518195
H 0.041435 -1.221889 0.498922
H -2.175923 -1.855700 -1.600417
H -2.320899 3.517572 1.053914
H -4.052154 3.547735 1.409123
H -4.606396 2.635023 -0.824171
H -3.570116 4.054297 -1.012436
H -0.105026 -1.241999 -3.142856
H 0.004598 -2.810196 -2.232547
H -0.747432 -4.606099 1.312561
H 2.006542 0.191159 -2.546254
H 0.657863 0.632947 -1.420353
H 1.643160 -1.278077 0.860649
H 3.654368 1.742152 -1.487571
H 3.252780 -0.883462 2.720699
H 5.240703 2.137033 0.375618
H 5.049180 0.827298 2.480709


%chk=000181052-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000181052

0 1
O -1.331892 0.335013 -1.461344
O -1.263220 -2.872293 0.473341
O 1.231995 -1.443597 -1.209385
O 0.346358 -2.753620 2.183076
C -2.592365 0.726787 0.653079
C -2.557885 0.933368 -0.879905
C -2.493895 -0.782202 0.980503
C -3.858444 1.393115 1.242533
C -2.579446 2.417516 -1.259776
C -1.257028 -1.380963 0.296127
C -1.263305 -1.123744 -1.225543
C -3.916807 2.895313 0.876267
C -3.828229 3.109022 -0.655884
C -0.015292 -1.668427 -1.940033
C -0.409313 -3.399862 1.431797
C 1.813335 -0.100134 -1.402049
C 2.972081 0.076945 -0.438752
C 2.979279 -0.563293 0.826280
C 4.046284 0.935563 -0.783783
C 4.042662 -0.338665 1.729818
C 5.105007 1.165419 0.123483
C 5.105825 0.528636 1.386312
H -1.699101 1.239396 1.070353
H -3.442752 0.415696 -1.325405
H -2.431270 -0.937437 2.073487
H -3.402546 -1.305044 0.618458
H -4.761449 0.879388 0.849985
H -3.871283 1.262435 2.342206
H -1.656792 2.894451 -0.874235
H -2.566033 2.519824 -2.360604
H -0.325418 -0.985563 0.736355
H -2.165622 -1.605361 -1.670504
H -3.073908 3.422737 1.367944
H -4.848897 3.346076 1.267722
H -4.741937 2.699642 -1.134568
H -3.804710 4.189935 -0.890608
H 0.028743 -1.232567 -2.960108
H -0.101807 -2.765374 -2.018218
H -0.514196 -4.501160 1.419142
H 2.160993 0.004071 -2.452610
H 1.029865 0.665403 -1.226804
H 2.168276 -1.248552 1.091654
H 4.058320 1.424333 -1.766718
H 4.038820 -0.843763 2.702487
H 5.929403 1.831036 -0.157384
H 5.928293 0.700898 2.090010


