%chk=000238483.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000238483

0 1
O -2.315397 1.793159 -2.239016
N 3.015253 -0.235380 -0.288276
N -0.301309 -2.284627 0.149988
C -0.312677 0.884197 -1.276092
C 0.619956 2.099692 -1.446603
C -0.172360 -0.129512 -2.423838
C 2.107904 1.730550 -1.407738
C -0.836336 -1.475324 -2.097795
C -1.749252 1.417603 -1.233637
C -2.411166 1.508398 0.105089
C 2.500984 1.018868 -0.140691
C 0.016779 -2.305039 -1.175087
C -2.272672 0.496634 1.063442
C -3.212193 2.628564 0.378615
C 2.354531 1.622139 1.125986
C 1.093456 -3.071802 -1.672053
C -2.921222 0.613707 2.296601
C -3.849571 2.746773 1.615466
C 2.739464 0.907477 2.260610
C 1.850330 -3.829100 -0.779822
C -3.703599 1.738664 2.575217
C 3.383284 -0.916749 0.827920
C 0.447951 -3.030495 1.005815
C 3.261569 -0.382860 2.119926
C 1.527664 -3.817942 0.583018
H -0.058863 0.369923 -0.312961
H 0.398224 2.842764 -0.654013
H 0.397554 2.605203 -2.409912
H 0.903787 -0.286395 -2.648032
H -0.624767 0.291364 -3.346594
H 2.358166 1.096339 -2.290194
H 2.724845 2.646731 -1.519883
H -1.025749 -2.034757 -3.037239
H -1.842427 -1.309820 -1.652750
H -1.668331 -0.392947 0.848836
H -3.339164 3.398295 -0.384988
H 1.944197 2.624461 1.212306
H 1.333672 -3.055560 -2.731917
H -2.817061 -0.176497 3.038067
H -4.465704 3.618058 1.829005
H 2.633357 1.351451 3.250336
H 2.688361 -4.425653 -1.139942
H -4.204463 1.828738 3.538089
H 3.782869 -1.923910 0.661573
H 0.155579 -2.982683 2.060556
H 3.566724 -0.958785 2.988054
H 2.096724 -4.406816 1.295357


%chk=000238483-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000238483

0 1
O -2.182118 2.014127 -2.203011
N 3.127917 -0.137681 -0.289858
N -0.287018 -2.151565 0.125546
C -0.246814 0.924233 -1.218733
C 0.679023 2.176922 -1.355782
C -0.090408 -0.059996 -2.405579
C 2.203910 1.874953 -1.368886
C -0.810856 -1.426152 -2.182838
C -1.685044 1.479765 -1.163344
C -2.455465 1.480584 0.125482
C 2.704014 1.157453 -0.127806
C -0.078963 -2.342963 -1.219156
C -2.229588 0.517649 1.146750
C -3.469989 2.463049 0.300660
C 2.725226 1.796325 1.141061
C 0.804591 -3.349058 -1.692828
C -3.006234 0.551758 2.326905
C -4.227709 2.502925 1.486790
C 3.196810 1.090001 2.267546
C 1.478665 -4.179293 -0.772876
C -3.995797 1.545870 2.505910
C 3.578991 -0.810709 0.809879
C 0.374288 -2.958973 1.005720
C 3.635777 -0.244780 2.102797
C 1.259764 -3.985061 0.610256
H 0.000223 0.403999 -0.277843
H 0.457609 2.872965 -0.521071
H 0.411452 2.707685 -2.289969
H 0.981871 -0.253724 -2.589917
H -0.510534 0.422738 -3.308684
H 2.470522 1.259441 -2.244260
H 2.733675 2.842439 -1.475691
H -0.904585 -1.936009 -3.159659
H -1.835032 -1.246967 -1.806236
H -1.498064 -0.287210 0.996888
H -3.643518 3.179590 -0.509342
H 2.379155 2.831779 1.233563
H 0.952847 -3.472484 -2.770700
H -2.843385 -0.203087 3.104533
H -4.998248 3.270421 1.620799
H 3.225092 1.569444 3.252177
H 2.157500 -4.963240 -1.126068
H -4.588221 1.571957 3.427911
H 3.903924 -1.842888 0.633148
H 0.177212 -2.769410 2.067801
H 4.012551 -0.829724 2.947922
H 1.753884 -4.610000 1.360892


