%chk=000220358.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000220358

0 1
O 0.465717 -2.741669 -0.625528
O -5.182951 -1.239390 -1.078818
O 5.530611 1.166973 -0.738104
C -1.634964 -0.263840 -0.085159
C -0.851431 0.957680 0.493785
C -3.183147 -0.091081 -0.146619
C -1.270454 2.223847 -0.296386
C -3.520843 1.233239 -0.877776
C -1.216023 -1.542250 0.652782
C -2.786016 2.437585 -0.285473
C 0.647064 0.688955 0.309610
C 0.278363 -1.841812 0.484040
C -1.065495 1.179977 2.000296
C -3.751415 -1.265311 -1.003276
C -3.866426 -0.137488 1.223488
C 1.154518 -0.620200 0.300736
C 1.551426 1.758631 0.193071
C 2.529309 -0.846345 0.125643
C 3.415710 0.222391 -0.020868
C 2.916416 1.532607 0.031590
C 4.907270 -0.003876 -0.180512
C 5.257396 -1.217555 -1.036345
H -1.295224 -0.359714 -1.151548
H -0.911029 2.142440 -1.340576
H -0.770128 3.116617 0.126265
H -4.612814 1.409593 -0.838487
H -3.263421 1.143135 -1.951118
H -1.793066 -2.417484 0.287322
H -1.460887 -1.458926 1.730133
H -3.136777 2.627345 0.748027
H -3.038317 3.349484 -0.860665
H 0.649279 -2.465394 1.335461
H -0.737194 0.314900 2.587010
H -0.501623 2.047912 2.358430
H -2.127039 1.352528 2.231866
H -3.557683 -2.247856 -0.530107
H -3.343525 -1.268517 -2.028043
H -3.580207 0.720216 1.848171
H -4.959465 -0.131232 1.113900
H -3.614612 -1.048255 1.776688
H 1.187290 2.785498 0.236364
H 2.892626 -1.875903 0.099257
H 0.280280 -2.292140 -1.472685
H 3.609621 2.373428 -0.049108
H -5.490715 -0.394142 -1.461306
H 5.394994 -0.055897 0.825160
H 4.680960 -1.250530 -1.967714
H 5.073717 -2.158594 -0.505395
H 6.321812 -1.198465 -1.307581
H 5.245413 1.306887 -1.662698


%chk=000220358-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000220358

0 1
O 0.319682 -2.573535 -1.087937
O -5.239030 -1.155699 -1.245721
O 5.559129 1.104494 -1.096472
C -1.682312 -0.258237 -0.028053
C -0.863450 0.977091 0.509254
C -3.249542 -0.113988 -0.062972
C -1.330330 2.245692 -0.272772
C -3.614969 1.223330 -0.779219
C -1.174875 -1.558379 0.638141
C -2.859726 2.447086 -0.222519
C 0.642386 0.699348 0.266803
C 0.277593 -1.860644 0.225157
C -1.011913 1.238325 2.042496
C -3.805675 -1.285164 -0.942216
C -3.951712 -0.199158 1.318678
C 1.165568 -0.622018 0.178384
C 1.569442 1.775459 0.195450
C 2.559782 -0.829221 0.007855
C 3.472411 0.243289 -0.066306
C 2.949511 1.561277 0.031473
C 4.985716 0.049989 -0.219947
C 5.420642 -1.344844 -0.703295
H -1.396690 -0.320770 -1.108588
H -1.009145 2.153728 -1.331100
H -0.836223 3.148734 0.133185
H -4.706402 1.397740 -0.698491
H -3.373183 1.127210 -1.862015
H -1.780957 -2.433841 0.348563
H -1.234502 -1.477428 1.739817
H -3.184124 2.650971 0.816314
H -3.129764 3.346061 -0.810090
H 0.711053 -2.617363 0.902992
H -0.735134 0.353730 2.641646
H -0.330973 2.056530 2.340241
H -2.035809 1.532331 2.321771
H -3.742875 -2.246720 -0.407568
H -3.214077 -1.361337 -1.881818
H -3.872529 0.737374 1.895309
H -5.025633 -0.408613 1.160455
H -3.535080 -1.014173 1.937313
H 1.207140 2.806276 0.266969
H 2.911677 -1.863737 -0.073509
H 0.144426 -1.909422 -1.803717
H 3.640689 2.408906 -0.027077
H -5.370456 -0.382799 -1.850313
H 5.479815 0.265998 0.746227
H 4.925884 -1.614471 -1.655333
H 5.182146 -2.127905 0.039194
H 6.512117 -1.345491 -0.862532
H 5.127181 1.031987 -1.986908


