%chk=000289429.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000289429

0 1
O -3.493928 1.402952 -0.634825
O -5.865491 -0.317580 1.008525
O 4.819210 1.420569 -2.702742
O 2.779511 2.139117 0.982718
O 8.874074 -3.027031 -0.712857
O 8.569440 -1.879849 -2.522520
N 1.982860 2.342182 -1.179336
N 8.328380 -2.147459 -1.358200
C 0.585961 2.087165 -0.949913
C 4.367237 2.657872 -0.733461
C 5.649397 0.428725 -0.714728
C -2.133599 1.622453 -0.633001
C -4.159844 1.229670 0.652286
C -5.592684 0.892623 0.245068
C 4.938099 1.478980 -1.500047
C 2.975419 2.355397 -0.200167
C 0.045916 1.958023 0.337500
C -0.245339 1.978846 -2.090171
C -1.322790 1.724254 0.501347
C -1.603550 1.747980 -1.936340
C -7.077561 -0.950458 0.804251
C 6.614800 -0.342414 -1.379030
C 5.360920 0.179466 0.636689
C -9.424131 -2.438212 0.617161
C 7.296074 -1.340022 -0.670032
C -8.083188 -0.521340 -0.064930
C -7.217063 -2.114642 1.588558
C -9.258279 -1.279589 -0.149402
C -8.391701 -2.848067 1.486485
C 6.041281 -0.829230 1.327817
C 7.014351 -1.592874 0.683845
C -10.677515 -3.246902 0.526141
H 5.021681 2.941901 0.121418
H 4.362575 3.558863 -1.386758
H -3.692028 0.390106 1.204812
H -4.076229 2.169917 1.220541
H -5.661667 0.673943 -0.839540
H -6.321800 1.666337 0.535582
H 2.254880 2.472154 -2.160180
H 0.689262 2.035655 1.222336
H 0.173255 2.072469 -3.092243
H -1.726929 1.623668 1.504592
H -2.267759 1.658030 -2.794560
H 6.832506 -0.169458 -2.443929
H 4.591244 0.764856 1.161245
H -7.976638 0.371689 -0.670198
H -6.409058 -2.414957 2.251280
H -10.048868 -0.954673 -0.824923
H -8.517230 -3.750725 2.083930
H 5.806207 -1.019765 2.377169
H 7.558411 -2.384345 1.213734
H -10.467031 -4.269508 0.181648
H -11.173499 -3.326088 1.503892
H -11.408952 -2.818174 -0.170637


%chk=000289429-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000289429

0 1
O -3.283291 0.428643 -0.924583
O -6.202705 -0.595229 1.008100
O 4.649490 1.928797 -2.270272
O 2.702751 2.098859 1.610272
O 9.426593 -2.310774 -1.808911
O 8.377846 -1.117533 -3.445621
N 2.109010 2.127919 -0.673310
N 8.570385 -1.433060 -2.211193
C 0.750708 1.690476 -0.649639
C 4.373933 2.826816 -0.044915
C 6.038226 0.882919 -0.598726
C -1.950230 0.841353 -0.759919
C -4.053267 0.124062 0.288885
C -5.438123 -0.289993 -0.205386
C 5.019819 1.883093 -1.054768
C 2.971907 2.308727 0.390082
C 0.045095 1.410106 0.546731
C 0.090862 1.541383 -1.900805
C -1.300583 0.986693 0.489123
C -1.246561 1.120868 -1.957552
C -7.542146 -1.002902 0.843827
C 6.805282 0.213578 -1.586658
C 6.226414 0.562048 0.773704
C -10.265577 -1.843243 0.739093
C 7.751345 -0.739884 -1.176824
C -8.190001 -1.138500 -0.405744
C -8.244314 -1.284195 2.041222
C -9.542116 -1.556482 -0.441969
C -9.587246 -1.698107 1.981216
C 7.173146 -0.414194 1.155751
C 7.953613 -1.070650 0.182603
C -11.716444 -2.291869 0.693622
H 4.966673 2.967479 0.868084
H 4.249186 3.805616 -0.542434
H -3.580883 -0.702507 0.854955
H -4.125999 1.016293 0.941126
H -5.365002 -1.180733 -0.860183
H -5.910231 0.537221 -0.771416
H 2.518096 2.284975 -1.604201
H 0.550251 1.521133 1.507992
H 0.628997 1.752607 -2.833217
H -1.823355 0.775294 1.426319
H -1.762316 1.002047 -2.914766
H 6.655735 0.438857 -2.646461
H 5.618348 1.048199 1.543488
H -7.668218 -0.927043 -1.343877
H -7.722805 -1.172812 2.997017
H -10.037944 -1.659218 -1.414821
H -10.121333 -1.913407 2.914971
H 7.302085 -0.663376 2.213276
H 8.701038 -1.823191 0.447448
H -11.845242 -3.291548 1.150273
H -12.372798 -1.594973 1.248514
H -12.089507 -2.348138 -0.343623


