%chk=000251348.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000251348

0 1
O -3.685675 -1.173791 -0.760392
O -3.191080 1.149077 1.245679
O -0.972421 -3.184058 -0.915027
O -1.597775 2.420616 0.473188
O 1.020895 -2.785903 -0.134153
O -1.080967 0.235120 1.071494
O 0.075876 -1.240893 -1.590335
C -4.534555 -0.580686 0.229576
C -3.235021 -2.520345 -0.471782
C -3.773236 -0.173201 1.489899
C -2.218800 -2.791944 -1.577354
C -0.291618 2.717778 0.008433
C 2.147629 -1.971691 0.145646
C -1.857085 1.146222 0.921436
C 0.038674 -2.255265 -0.942492
C 0.422051 1.865518 -0.833472
C 2.004873 -0.704219 0.711604
C 0.157376 3.987289 0.389152
C 3.382556 -2.587448 -0.078493
C 1.652621 2.319287 -1.318247
C 3.171028 -0.023160 1.070896
C 1.386336 4.415921 -0.118097
C 4.530547 -1.885729 0.299777
C 2.132084 3.585797 -0.964533
C 4.426054 -0.610091 0.867731
H -4.902924 0.317133 -0.317053
H -5.380754 -1.248911 0.465425
H -2.761499 -2.565584 0.527945
H -4.103317 -3.199327 -0.509990
H -2.985709 -0.896071 1.776898
H -4.441111 0.033369 2.346938
H -2.069824 -1.900993 -2.226024
H -2.451082 -3.683836 -2.185001
H 0.042016 0.872880 -1.104777
H 1.013481 -0.262912 0.865650
H -0.443802 4.610766 1.046910
H 3.433765 -3.578980 -0.522093
H 2.236542 1.674785 -1.977241
H 3.096989 0.971149 1.512241
H 1.765018 5.401684 0.150399
H 5.511057 -2.335493 0.146869
H 3.089837 3.928981 -1.351451
H 5.327352 -0.070940 1.153820


%chk=000251348-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000251348

0 1
O -3.834349 -1.173582 -0.787143
O -3.771463 1.384789 0.826361
O -0.779879 -3.229646 -0.978752
O -2.069514 2.638341 0.168512
O 1.331447 -3.046822 -0.324410
O -1.600374 0.548481 1.168935
O 0.279314 -1.153898 -1.268376
C -4.866397 -0.738341 0.150307
C -2.842547 -2.104916 -0.225657
C -4.353004 0.110902 1.322750
C -2.064166 -2.627446 -1.440982
C -0.694967 2.976192 -0.095236
C 2.554640 -2.367297 0.004422
C -2.389179 1.423573 0.751620
C 0.276660 -2.342516 -0.891130
C 0.217311 2.057722 -0.652437
C 2.577231 -1.090819 0.604599
C -0.356324 4.320438 0.154150
C 3.729389 -3.110053 -0.222559
C 1.522969 2.515380 -0.945750
C 3.829798 -0.546620 0.969022
C 0.950803 4.759512 -0.152659
C 4.971412 -2.551913 0.153218
C 1.894271 3.857712 -0.698977
C 5.025351 -1.268778 0.746452
H -5.564596 -0.146424 -0.464254
H -5.410946 -1.613181 0.574712
H -2.155651 -1.570383 0.458869
H -3.345398 -2.929745 0.322294
H -3.599798 -0.420324 1.930611
H -5.201674 0.415345 1.958290
H -1.861332 -1.791954 -2.132016
H -2.582102 -3.446416 -1.959844
H -0.058393 1.019972 -0.854070
H 1.655097 -0.531025 0.780544
H -1.107408 4.995869 0.574162
H 3.657935 -4.101360 -0.679472
H 2.243160 1.811114 -1.376345
H 3.862914 0.444894 1.433336
H 1.227551 5.802566 0.034935
H 5.891868 -3.120079 -0.018161
H 2.907387 4.199914 -0.936237
H 5.989356 -0.837276 1.035966


