%chk=000221455.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221455

0 1
O 1.266670 0.234838 0.525481
O 2.155986 -0.524094 -1.410089
C -1.090899 -0.277462 0.415340
C 0.015723 0.633745 -0.150881
C -2.451675 0.255147 -0.070898
C -1.536614 2.619094 -0.230432
C -0.161811 2.102714 0.237437
C -2.658850 1.721183 0.328683
C -0.846236 -1.764679 0.045517
C -1.737987 4.074957 0.200980
C -1.877335 -2.673114 0.727839
C -0.821813 -2.010491 -1.465804
C 2.266048 -0.339508 -0.219692
C 3.430060 -0.638450 0.688695
C 3.956417 -2.045262 0.439665
H -1.057250 -0.203295 1.531602
H 0.146808 0.502527 -1.248200
H -3.264403 -0.365336 0.352126
H -2.530147 0.145035 -1.169947
H -1.569550 2.572981 -1.347626
H 0.651262 2.710124 -0.200746
H -0.055848 2.214974 1.334194
H -3.640073 2.074350 -0.038385
H -2.698552 1.809898 1.430875
H 0.165439 -2.031355 0.451361
H -0.956263 4.724544 -0.208048
H -2.700849 4.464240 -0.147557
H -1.716189 4.185005 1.290813
H -2.884607 -2.517692 0.326615
H -1.629452 -3.729483 0.576731
H -1.919314 -2.496768 1.807479
H -1.744874 -1.683202 -1.953186
H -0.691253 -3.073817 -1.692879
H 0.017209 -1.478493 -1.940586
H 4.223931 0.117035 0.500138
H 3.133665 -0.508384 1.752667
H 4.195685 -2.201025 -0.622973
H 4.869220 -2.233710 1.016991
H 3.221721 -2.810070 0.721701


%chk=000221455-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000221455

0 1
O 1.124517 -0.279244 0.638539
O 2.491463 0.180819 -1.199848
C -1.317220 -0.393575 0.445948
C -0.058197 0.343415 -0.056343
C -2.566376 0.308955 -0.155859
C -1.326394 2.545578 -0.316734
C -0.072331 1.847811 0.269716
C -2.601815 1.819064 0.177232
C -1.265350 -1.934642 0.189953
C -1.342633 4.047559 0.036832
C -2.399397 -2.670343 0.944674
C -1.274480 -2.320983 -1.309981
C 2.345218 -0.271915 -0.040042
C 3.436936 -0.872892 0.834639
C 4.729681 -1.173745 0.055181
H -1.352064 -0.251290 1.548938
H 0.085811 0.201328 -1.144744
H -3.482754 -0.180857 0.223226
H -2.570307 0.185130 -1.257610
H -1.287199 2.448155 -1.423975
H 0.846947 2.317669 -0.127600
H -0.066356 1.974487 1.371566
H -3.498810 2.285352 -0.276010
H -2.689350 1.955235 1.276073
H -0.303487 -2.280839 0.619653
H -0.437007 4.559562 -0.338320
H -2.223863 4.551990 -0.401963
H -1.382728 4.191440 1.133833
H -3.394194 -2.429382 0.524954
H -2.268198 -3.766056 0.870939
H -2.408323 -2.402004 2.018165
H -2.225638 -2.035231 -1.796639
H -1.162462 -3.415487 -1.421621
H -0.447757 -1.846230 -1.869568
H 3.633586 -0.154064 1.655003
H 3.032020 -1.778764 1.322118
H 5.105817 -0.265805 -0.445771
H 5.511845 -1.550849 0.737527
H 4.554848 -1.932652 -0.727082


