%chk=000262646.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000262646

0 1
O 0.001428 3.013114 -1.088012
O 6.482605 -2.826801 0.069697
O -6.480382 -2.818288 0.108418
O 4.372195 -3.102420 -0.319594
O -4.373062 -3.096706 -0.295349
N 0.008154 -0.102773 1.677728
N 5.353739 -2.405937 -0.118576
N -5.352187 -2.398940 -0.087125
C 1.232134 0.717235 1.455166
C -1.216327 0.718484 1.462630
C 1.282920 1.426320 0.126280
C -1.274429 1.427860 0.134193
C 0.003165 2.055702 -0.340725
C 0.004977 -1.335526 0.838026
C 2.377197 1.552043 -0.637974
C -2.373315 1.555062 -0.623172
C 3.697311 0.972024 -0.339549
C -3.692279 0.976752 -0.316399
C 3.881779 -0.416587 -0.359997
C -3.878916 -0.411564 -0.336742
C 4.785869 1.819121 -0.064151
C -4.777702 1.825236 -0.033019
C 5.157017 -0.935963 -0.099260
C -5.153158 -0.929273 -0.067920
C 6.049639 1.282747 0.196625
C -6.040494 1.290511 0.235748
C 6.247273 -0.100178 0.179909
C -6.240283 -0.092110 0.219206
H 2.123635 0.067064 1.606560
H 1.279302 1.478817 2.272412
H -1.257840 1.479957 2.280277
H -2.107549 0.069155 1.619226
H 0.001900 -1.157822 -0.246919
H -0.878854 -1.944030 1.093943
H 0.889589 -1.945045 1.088783
H 2.338566 2.132069 -1.573429
H -2.339847 2.135034 -1.558844
H 3.047884 -1.093117 -0.579339
H -3.047502 -1.089140 -0.562169
H 4.639459 2.901513 -0.051733
H -4.629593 2.907397 -0.020687
H 6.888792 1.946431 0.412648
H -6.877206 1.955245 0.457930
H 7.233204 -0.534069 0.378980
H -7.225509 -0.524704 0.424498


%chk=000262646-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000262646

0 1
O 0.002175 2.715381 -0.909544
O 7.242612 -2.309819 0.370196
O -7.236530 -2.300876 0.416032
O 5.041145 -2.900508 0.423462
O -5.035464 -2.894099 0.455911
N 0.006193 -0.797706 1.411728
N 5.985529 -2.027765 0.305145
N -5.979549 -2.020298 0.343117
C 1.219074 0.048400 1.453917
C -1.203992 0.051827 1.462663
C 1.301191 1.057399 0.301321
C -1.291872 1.059751 0.309661
C 0.003769 1.699166 -0.139727
C 0.000779 -1.821419 0.342977
C 2.432704 1.489631 -0.344691
C -2.426660 1.492666 -0.330117
C 3.838071 1.058229 -0.211689
C -3.831723 1.062981 -0.188305
C 4.231596 -0.288756 0.009000
C -4.225468 -0.283462 0.035343
C 4.864536 2.034679 -0.386750
C -4.858115 2.040528 -0.357521
C 5.600787 -0.607302 0.082988
C -5.594541 -0.600370 0.118006
C 6.230435 1.693955 -0.295837
C -6.223828 1.701434 -0.257984
C 6.619759 0.359946 -0.054560
C -6.613218 0.368010 -0.013623
H 2.106922 -0.597837 1.509303
H 1.188697 0.619257 2.405968
H -1.164551 0.623445 2.413915
H -2.093257 -0.591750 1.525462
H -0.002454 -1.412482 -0.694861
H -0.890820 -2.462106 0.463263
H 0.891366 -2.464714 0.456646
H 2.262556 2.310553 -1.059787
H -2.259841 2.312660 -1.047054
H 3.504613 -1.100863 0.073472
H -3.499084 -1.096432 0.095555
H 4.576789 3.073058 -0.587521
H -4.570416 3.078480 -0.560549
H 6.993993 2.467790 -0.422125
H -6.987248 2.476102 -0.379928
H 7.668010 0.058905 0.013860
H -7.661372 0.068230 0.061459


