%chk=000267127.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267127

0 1
O 0.399125 3.653949 0.852634
O -1.641760 3.015512 0.251810
N 3.056734 0.999218 -0.983686
N -2.937995 -1.055299 1.339489
C -0.034116 1.285426 1.101851
C 1.168504 0.896173 0.290241
C -1.166657 0.317310 0.919935
C 1.694497 -0.441125 0.158593
C -1.626789 -0.219824 -0.338219
C 0.387802 1.414428 2.578506
C 2.020009 1.748463 -0.405572
C -1.986328 -0.200669 1.918364
C 2.882784 -0.353018 -0.646231
C -2.744593 -1.075941 -0.052415
C -0.565883 2.671232 0.669191
C 1.291099 -1.704737 0.635384
C -1.212622 -0.066875 -1.676935
C 3.653873 -1.489742 -0.969489
C -3.438570 -1.765576 -1.069124
C 4.148940 1.542024 -1.796186
C -4.000066 -1.760394 2.062398
C 2.051630 -2.815167 0.318121
C -1.896047 -0.744396 -2.669957
C 3.223581 -2.707676 -0.478131
C -3.000208 -1.586147 -2.367613
H 1.209017 2.138707 2.682091
H 0.754771 0.452270 2.957220
H -0.432812 1.748390 3.219848
H 1.958692 2.820885 -0.509687
H -1.955654 -0.024680 2.978760
H 0.384455 -1.787360 1.233592
H -0.362431 0.574076 -1.905343
H 4.545281 -1.400637 -1.579447
H -4.281179 -2.404354 -0.832104
H 4.150115 1.086451 -2.803945
H 4.050820 2.634321 -1.916000
H 5.127689 1.337081 -1.323788
H -3.886989 -1.642571 3.153007
H -4.995010 -1.368763 1.777544
H -3.976689 -2.841408 1.830935
H 1.755236 -3.799116 0.674328
H -1.592735 -0.639955 -3.709218
H 3.785408 -3.613382 -0.700806
H -3.504653 -2.095569 -3.187094
H 0.059023 4.557065 0.624448


%chk=000267127-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000267127

0 1
O 0.432349 3.716668 0.941333
O -1.640627 3.029636 0.195228
N 3.092541 0.955478 -1.027122
N -2.945547 -1.092274 1.300492
C -0.039734 1.307029 1.083526
C 1.195880 0.896629 0.268276
C -1.189920 0.326022 0.873689
C 1.766357 -0.443585 0.218937
C -1.714964 -0.154345 -0.394445
C 0.365930 1.390621 2.594718
C 2.035008 1.709060 -0.496080
C -1.967198 -0.264234 1.870728
C 2.951575 -0.369895 -0.598099
C -2.809782 -1.039537 -0.093657
C -0.530987 2.718009 0.670214
C 1.405788 -1.700602 0.776306
C -1.376683 0.070054 -1.755037
C 3.770006 -1.491734 -0.859817
C -3.561639 -1.692341 -1.096140
C 4.168301 1.459080 -1.880053
C -3.947677 -1.873528 2.023415
C 2.218461 -2.821672 0.521857
C -2.119610 -0.577564 -2.760055
C 3.389555 -2.721022 -0.286112
C -3.201484 -1.449377 -2.436522
H 1.195279 2.103333 2.718014
H 0.697041 0.396795 2.940597
H -0.481057 1.724856 3.221925
H 1.972087 2.778400 -0.681457
H -1.903582 -0.163790 2.952514
H 0.498125 -1.798789 1.379656
H -0.547098 0.733903 -2.017567
H 4.666304 -1.416360 -1.485199
H -4.393537 -2.361123 -0.849235
H 4.159577 0.962583 -2.868534
H 4.036158 2.541842 -2.034005
H 5.156704 1.292321 -1.412350
H -3.822420 -1.717383 3.106861
H -4.971315 -1.561654 1.743450
H -3.839924 -2.954090 1.812253
H 1.944919 -3.794790 0.945010
H -1.866029 -0.411626 -3.813160
H 3.998789 -3.613907 -0.466622
H -3.760579 -1.936868 -3.243355
H 0.033959 4.598369 0.702922


