%chk=000093950.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000093950

0 1
O 5.367531 1.743566 -0.399657
O -0.297882 -3.651848 0.010668
O -2.386511 -3.878215 0.637480
N 0.606308 -1.111878 0.023887
N -4.462819 0.763615 -0.244241
N -5.446650 3.927822 -0.422071
N -4.409737 3.982740 -0.010724
C -0.584664 -0.653006 0.258278
C -1.713341 -1.623538 0.230910
C 1.798779 -0.335206 -0.040592
C -0.956464 0.753129 0.543838
C -2.982557 -1.186447 0.145372
C -3.323305 0.262959 0.087130
C -2.219841 1.187242 0.459710
C 2.924290 -0.845696 0.632594
C 1.906528 0.835563 -0.824497
C 4.237781 0.982132 -0.222348
C 4.149165 -0.182625 0.552609
C 3.122053 1.496271 -0.920252
C -1.500936 -3.115410 0.319244
C 6.588739 1.309843 0.248779
H 0.443261 -2.985777 -0.213737
H -0.137762 1.417106 0.836749
H -3.822689 -1.894198 0.132518
H -2.507202 2.226726 0.655208
H 2.836610 -1.759541 1.223769
H 1.039970 1.208308 -1.372204
H 5.010704 -0.577658 1.082890
H 3.237712 2.396628 -1.522011
H -5.230071 0.148759 -0.506599
H 7.296821 2.086853 -0.070229
H 6.890857 0.327883 -0.126455
H 6.465322 1.315199 1.335381


%chk=000093950-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000093950

0 1
O 5.498619 1.688536 -0.423112
O -0.105341 -3.447957 0.285413
O -2.354059 -3.966808 0.155401
N 0.607169 -1.047143 0.189513
N -4.704362 0.626407 -0.028395
N -5.561517 4.257510 0.152447
N -4.473260 3.906117 0.186364
C -0.656013 -0.593873 0.147200
C -1.726305 -1.618173 0.139027
C 1.794790 -0.310449 0.042457
C -1.054598 0.816216 0.170024
C -3.044674 -1.229028 0.067616
C -3.448763 0.184304 0.041679
C -2.375488 1.186931 0.129485
C 2.946433 -0.809423 0.716858
C 1.946956 0.828265 -0.813296
C 4.317439 0.977289 -0.222961
C 4.191793 -0.166928 0.610009
C 3.191433 1.455552 -0.947478
C -1.426742 -3.121766 0.189354
C 6.709166 1.228365 0.271493
H 0.457205 -2.525950 0.278042
H -0.276726 1.576913 0.280386
H -3.810619 -2.015177 0.035459
H -2.687633 2.233948 0.180422
H 2.838621 -1.701068 1.342912
H 1.105554 1.175089 -1.420664
H 5.049322 -0.564202 1.159883
H 3.327332 2.308411 -1.618906
H -5.389596 -0.161616 -0.069722
H 7.497359 1.929082 -0.037706
H 6.978202 0.200612 -0.037127
H 6.578301 1.271316 1.369321


