%chk=000272952.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000272952

0 1
O 3.741088 0.224693 -1.910321
O 1.874091 2.495473 0.548533
O 4.812756 0.895986 -0.030578
O 2.307233 1.203863 2.368210
O -0.308291 -0.336278 0.533495
O -2.784776 -1.901409 -1.847999
O -2.481224 2.418366 -0.209698
N 1.354743 0.301378 -0.909059
N -2.351288 0.309176 -1.217699
N 3.528016 -4.457201 0.975387
C 2.439541 0.235240 0.089858
C 2.515540 -1.135357 0.796945
C -0.969719 0.391049 -1.699161
C 3.809731 0.513492 -0.571943
C 2.207727 1.332002 1.178616
C 2.651820 -2.296739 -0.194170
C 0.012522 0.079335 -0.560170
C -4.365548 -0.593926 -0.472682
C -4.272509 0.737111 0.026695
C -3.127222 -0.914414 -1.255792
C -2.967796 1.336520 -0.407924
C -5.466750 -1.379602 -0.210865
C -5.281117 1.285580 0.788557
C 4.965032 0.381588 -2.710656
C 1.436775 3.627606 1.382097
C 3.138219 -3.497675 0.463191
C -6.504082 -0.818330 0.572780
C -6.413737 0.480006 1.059407
C 5.883329 -0.795112 -2.473545
C -0.006511 3.421545 1.777225
H 3.354023 -1.123319 1.528725
H 1.594070 -1.271557 1.418486
H 1.614247 0.692600 -1.816760
H -0.828962 -0.337841 -2.536899
H -0.786721 1.417630 -2.103145
H 1.662954 -2.504312 -0.673293
H 3.333880 -2.026867 -1.038381
H -5.541053 -2.400711 -0.588330
H -5.213849 2.303380 1.175449
H 5.429659 1.349077 -2.448301
H 4.535791 0.409198 -3.729049
H 1.588529 4.464715 0.676788
H 2.118303 3.707677 2.247387
H -7.383893 -1.425265 0.794857
H -7.222653 0.894390 1.664040
H 6.754431 -0.763151 -3.141550
H 6.270027 -0.803792 -1.442093
H 5.377180 -1.754559 -2.639963
H -0.419060 4.307247 2.274467
H -0.649206 3.207771 0.906129
H -0.121993 2.572221 2.467104


%chk=000272952-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000272952

0 1
O 3.673989 0.545178 -1.876995
O 1.832696 2.362820 0.513620
O 4.917484 0.376039 0.089892
O 2.455237 1.171413 2.426515
O -0.323818 -0.075912 0.756584
O -2.698761 -2.162369 -1.516213
O -2.481837 2.435881 -0.544120
N 1.393331 0.012268 -0.811105
N -2.291763 0.154496 -1.182042
N 2.995329 -4.761196 1.495644
C 2.470725 0.052308 0.191068
C 2.589419 -1.263899 1.014248
C -0.913707 0.181218 -1.632743
C 3.823424 0.339779 -0.507162
C 2.240943 1.235706 1.202810
C 2.838637 -2.493434 0.104225
C 0.064654 0.020284 -0.442227
C -4.349598 -0.630973 -0.436889
C -4.282703 0.754143 -0.144051
C -3.068799 -1.040580 -1.093732
C -2.956748 1.274918 -0.603943
C -5.481369 -1.393640 -0.113889
C -5.346367 1.421495 0.480576
C 4.922185 0.857117 -2.655008
C 1.481290 3.569031 1.341744
C 2.920662 -3.745354 0.874437
C -6.562351 -0.727715 0.520684
C -6.495907 0.658216 0.813158
C 5.624017 -0.429012 -3.093171
C 0.026207 3.489268 1.806313
H 3.413364 -1.138859 1.735105
H 1.654980 -1.388517 1.584705
H 1.670133 0.231616 -1.772864
H -0.770314 -0.639480 -2.358787
H -0.718978 1.149408 -2.129848
H 2.022925 -2.588597 -0.637587
H 3.785413 -2.377141 -0.459677
H -5.520160 -2.463306 -0.341798
H -5.283488 2.490941 0.704198
H 5.571793 1.479316 -2.015882
H 4.548433 1.444438 -3.508282
H 1.656572 4.407751 0.649471
H 2.185203 3.617614 2.191265
H -7.461373 -1.291176 0.792128
H -7.344819 1.144121 1.305825
H 6.485962 -0.173906 -3.736817
H 6.005146 -0.988980 -2.223008
H 4.944832 -1.077144 -3.673354
H -0.230449 4.414477 2.355997
H -0.664416 3.386771 0.952423
H -0.123962 2.631656 2.482961


