%chk=000298535.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298535

0 1
O 1.878404 0.430725 0.627066
O 4.932149 0.022176 -0.348327
O 4.731419 1.664457 1.284462
O 3.790746 -2.101275 -0.778416
O 1.134627 -3.334162 -0.969194
O -3.305862 -2.308139 -1.310468
O -2.457960 1.619490 0.074776
O -6.378910 0.438811 -0.822967
O -5.233622 2.301030 -0.137251
N 0.477180 -1.224878 -0.268640
N -1.110737 -2.818628 -1.132169
N -4.175949 0.212635 -0.564161
C 3.690222 0.309871 -0.982081
C 2.772052 1.268190 -0.184829
C 2.900700 -1.029651 -1.014182
C 1.896249 -0.913567 0.176947
C 3.484850 2.184201 0.811442
C 5.620043 1.116207 0.299407
C 6.085580 2.157030 -0.706400
C 6.705104 0.425044 1.105242
C -0.542088 -0.304652 -0.106961
C 0.225066 -2.543919 -0.805962
C -1.840814 -0.589737 -0.464288
C -2.212412 -1.892029 -0.984718
C -2.819587 0.519176 -0.286934
C -5.244131 1.141695 -0.457118
C -7.653079 1.160398 -0.744159
C -8.077522 1.312026 0.699756
H 3.911376 0.687436 -2.003135
H 2.095735 1.844933 -0.853594
H 2.389382 -1.168207 -1.992467
H 2.151598 -1.559316 1.052078
H 3.658138 3.188700 0.384248
H 2.898201 2.268038 1.754544
H 5.266153 2.621271 -1.260712
H 6.762270 1.704902 -1.444606
H 6.634506 2.964216 -0.202689
H 6.686044 -0.662777 0.912163
H 6.525851 0.554645 2.185059
H 7.707796 0.795026 0.875167
H 3.311099 -2.962181 -0.951285
H -0.268003 0.687185 0.323069
H -1.323752 -3.760556 -1.502012
H -4.436505 -0.750026 -0.877721
H -7.537872 2.129320 -1.261764
H -8.298982 0.474117 -1.323752
H -9.097291 1.706945 0.779828
H -8.046868 0.353423 1.234177
H -7.413696 2.005180 1.240631


%chk=000298535-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000298535

0 1
O 1.969331 0.658899 0.311713
O 4.829543 -0.116172 -0.107061
O 4.647062 1.921898 1.189409
O 3.564234 -2.096758 -1.506522
O 1.152941 -3.281749 -0.952360
O -3.397757 -2.294743 -1.021123
O -2.452462 1.815891 0.012634
O -6.422289 0.300075 -0.636908
O -5.344698 2.327327 -0.115421
N 0.497716 -1.088506 -0.403416
N -1.114772 -2.724440 -0.950687
N -4.178015 0.270028 -0.466037
C 3.866056 0.320446 -1.120993
C 2.932799 1.415498 -0.559290
C 2.882373 -0.844912 -1.358554
C 1.944102 -0.727142 -0.104894
C 3.637970 2.479987 0.285468
C 5.587207 0.990480 0.530697
C 6.484791 1.715765 -0.492465
C 6.365072 0.333374 1.664088
C -0.520669 -0.171427 -0.251994
C 0.235682 -2.425567 -0.778576
C -1.856152 -0.475059 -0.456653
C -2.225107 -1.843725 -0.819522
C -2.842398 0.652432 -0.277324
C -5.303499 1.108733 -0.371168
C -7.744732 0.987053 -0.553536
C -8.247335 1.035314 0.891962
H 4.369622 0.629117 -2.057221
H 2.358524 1.905804 -1.372869
H 2.271371 -0.594400 -2.259074
H 2.296424 -1.385025 0.710507
H 4.082103 3.236290 -0.396023
H 2.909334 2.982659 0.941737
H 5.910917 2.196833 -1.303202
H 7.180615 0.991828 -0.949230
H 7.069672 2.497384 0.021281
H 7.066204 -0.414968 1.260032
H 5.658926 -0.167714 2.344645
H 6.925935 1.096074 2.229000
H 2.882411 -2.820153 -1.386906
H -0.224433 0.835926 0.051733
H -1.329601 -3.691919 -1.217023
H -4.348592 -0.726668 -0.706092
H -7.640335 2.002210 -0.975855
H -8.392407 0.372002 -1.198344
H -9.264291 1.469228 0.917437
H -8.292863 0.022085 1.327037
H -7.589635 1.665207 1.514062


