%chk=000270513.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270513

0 1
O 3.247201 2.040473 0.424926
O 3.188739 -1.137834 -0.967873
O 7.939551 -2.035733 0.486788
O 7.879295 0.106247 -0.161140
N 2.719700 1.045369 -0.437515
C 1.284048 0.920280 -0.278891
C 4.990093 0.117270 0.052693
C -1.508336 0.762349 -0.138723
C 3.588400 -0.116947 -0.453756
C 5.793097 -1.180081 0.061143
C 0.597970 0.003779 -1.094651
C 0.582634 1.753828 0.609325
C -0.792396 -0.069198 -1.016710
C -0.807098 1.676026 0.668950
C -2.975087 0.701751 -0.055920
C -3.672899 -0.442954 -0.074461
C -5.140822 -0.501769 0.013977
C 7.264445 -0.901111 0.096669
C -5.948311 0.396205 -0.703547
C -5.744377 -1.482432 0.821258
C -7.340281 0.315874 -0.609619
C -7.135635 -1.553170 0.914853
C -7.936391 -0.655600 0.199955
H 4.962401 0.578801 1.067315
H 5.494642 0.887830 -0.581135
H 5.555667 -1.798247 -0.842500
H 5.498012 -1.833211 0.914025
H 1.148026 -0.653216 -1.774890
H 1.125108 2.450006 1.249827
H -1.327090 -0.775895 -1.652384
H -1.352619 2.322395 1.356478
H -3.472790 1.670895 0.041278
H -3.175635 -1.415016 -0.140083
H -5.489216 1.149898 -1.340758
H -5.125814 -2.182830 1.379626
H 3.354221 2.845927 -0.184341
H -7.961636 1.012757 -1.169913
H -7.598673 -2.310509 1.545545
H -9.020287 -0.715020 0.273038
H 8.926342 -1.908888 0.508146


%chk=000270513-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000270513

0 1
O 3.295870 2.121828 -0.074529
O 3.346026 -1.472555 0.068978
O 8.413741 -1.635363 0.405119
O 7.829028 0.006758 -1.125249
N 2.752687 0.772493 -0.107151
C 1.320506 0.694673 -0.046354
C 5.166358 0.186051 0.008789
C -1.545700 0.613298 0.020115
C 3.703464 -0.258543 0.006125
C 6.095872 -0.994776 0.334960
C 0.631859 -0.539417 -0.232766
C 0.574187 1.881230 0.178291
C -0.771512 -0.564539 -0.196251
C -0.830464 1.830225 0.207678
C -3.013845 0.633472 0.062492
C -3.855181 -0.437530 -0.097888
C -5.325784 -0.419570 -0.054006
C 7.489447 -0.785104 -0.216325
C -6.093910 0.761045 0.176537
C -6.030723 -1.643265 -0.250562
C -7.500944 0.713821 0.207758
C -7.439813 -1.691300 -0.219579
C -8.184441 -0.511532 0.010047
H 5.306400 1.021445 0.715355
H 5.432540 0.592626 -0.987394
H 5.683179 -1.924491 -0.105120
H 6.158720 -1.187960 1.419136
H 1.201958 -1.456131 -0.385108
H 1.095859 2.824840 0.352824
H -1.270763 -1.528576 -0.341005
H -1.390487 2.756142 0.387702
H -3.453610 1.624741 0.243598
H -3.415018 -1.428606 -0.279670
H -5.589446 1.720909 0.333425
H -5.459553 -2.563222 -0.428770
H 3.284670 2.433558 -1.024097
H -8.071083 1.632597 0.386855
H -7.956567 -2.645187 -0.373643
H -9.279197 -0.543630 0.035352
H 9.309870 -1.502154 -0.008662


