%chk=000185133.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185133

0 1
O 4.635020 1.789230 -0.560939
O 3.979998 -2.687623 -0.276771
O -4.928221 -1.475759 0.269284
N 4.285034 -0.448769 -0.453141
N -4.177829 0.570454 -0.487468
C 1.526786 0.013464 0.236206
C 2.326091 1.095010 -0.527261
C 1.965504 -1.365663 -0.324967
C 1.835050 0.075610 1.756165
C 0.022762 0.171035 0.025651
C 3.818048 0.895566 -0.505749
C 3.451739 -1.598435 -0.337844
C 1.425608 1.390943 2.409101
C -0.546606 1.347331 -0.480710
C -0.837539 -0.881152 0.389518
C -1.926730 1.469253 -0.646902
C -2.216757 -0.782290 0.232604
C -2.772074 0.398419 -0.293451
C -5.183017 -0.383709 -0.193092
C -6.573358 0.091616 -0.508680
H 2.104064 2.103207 -0.108648
H 1.999124 1.136633 -1.590223
H 1.580114 -1.489453 -1.362424
H 1.487660 -2.192712 0.247041
H 2.915515 -0.100015 1.928207
H 1.315679 -0.761199 2.266208
H 1.995157 2.241284 2.016036
H 0.359550 1.604973 2.258828
H 1.600388 1.359777 3.491869
H 5.304812 -0.599893 -0.465697
H 0.078186 2.199386 -0.750075
H -0.426721 -1.801883 0.809348
H -2.335877 2.394001 -1.046474
H -2.864360 -1.619486 0.520041
H -4.461841 1.472081 -0.875397
H -6.858887 0.980240 0.069831
H -7.302066 -0.698759 -0.255496
H -6.712006 0.318086 -1.574230


%chk=000185133-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000185133

0 1
O 4.656351 1.917147 -0.500151
O 4.095745 -2.676315 -0.320480
O -5.091487 -1.459425 0.436767
N 4.314195 -0.373430 -0.441582
N -4.226941 0.511800 -0.503722
C 1.543814 0.008134 0.226920
C 2.330163 1.126463 -0.512279
C 2.024386 -1.353266 -0.372584
C 1.854767 0.030426 1.766988
C 0.021443 0.147918 0.007396
C 3.842688 0.956313 -0.473197
C 3.535901 -1.549704 -0.366691
C 1.474939 1.337936 2.493449
C -0.572449 1.281920 -0.603112
C -0.855092 -0.876102 0.456027
C -1.968862 1.382036 -0.762641
C -2.252760 -0.797301 0.307768
C -2.826310 0.346047 -0.311209
C -5.269755 -0.349573 -0.142725
C -6.655969 0.174545 -0.520132
H 2.117685 2.128551 -0.107160
H 2.036028 1.142512 -1.582207
H 1.680679 -1.434836 -1.423908
H 1.594754 -2.214793 0.164531
H 2.932399 -0.175728 1.923716
H 1.309870 -0.813013 2.233441
H 2.081625 2.195374 2.149854
H 0.409291 1.585426 2.341291
H 1.645963 1.232634 3.579794
H 5.334420 -0.498647 -0.442249
H 0.045358 2.110768 -0.961322
H -0.447209 -1.769821 0.942815
H -2.393725 2.275183 -1.239630
H -2.904796 -1.598243 0.659913
H -4.503930 1.380797 -0.967458
H -6.872174 1.138009 -0.022092
H -7.406352 -0.562774 -0.201689
H -6.746655 0.323830 -1.612149


