%chk=000258982.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258982

0 1
O -4.715746 1.297314 -0.467935
N -1.686574 -0.311722 0.236167
N 1.189630 -0.149441 -0.108533
N -3.652191 1.315336 1.528340
C -3.136208 -0.542453 -0.092732
C -0.845076 -1.549840 0.157583
C -1.061198 0.748337 -0.625244
C 0.564021 -1.238234 0.704186
C 0.339743 1.081398 -0.074690
C -3.722842 -1.644031 0.804754
C -3.410088 -0.862949 -1.567178
C -3.895508 0.775468 0.269401
C 2.599938 0.024418 0.003592
C 3.428781 -1.053864 0.393088
C 3.206649 1.239783 -0.392102
C 4.815148 -0.913331 0.376343
C 4.594833 1.359258 -0.401648
C 5.409167 0.290048 -0.015716
H -0.767390 -1.947551 -0.878623
H -1.300818 -2.344954 0.784590
H -1.689896 1.663826 -0.598666
H -0.978094 0.440477 -1.691929
H 0.501783 -0.960215 1.779974
H 1.190077 -2.157208 0.632876
H 0.802641 1.867790 -0.714451
H 0.259422 1.494850 0.955019
H -3.422498 -1.521537 1.852847
H -3.411881 -2.643587 0.481683
H -4.820943 -1.628303 0.774502
H -2.882707 -1.761885 -1.896737
H -3.126799 -0.035870 -2.230274
H -4.485084 -1.018907 -1.740159
H 2.991516 -2.003942 0.692070
H 2.595075 2.082559 -0.707543
H -2.877584 1.005560 2.094219
H -4.083175 2.188885 1.786486
H 5.442027 -1.753635 0.674586
H 5.049172 2.299805 -0.713243
H 6.489780 0.392448 -0.022799


%chk=000258982-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000258982

0 1
O -5.056689 1.120348 -0.005515
N -1.711569 -0.339566 0.150060
N 1.185130 -0.144122 -0.089819
N -3.277992 1.385433 1.480634
C -3.193223 -0.525015 -0.081538
C -0.876724 -1.564781 0.102256
C -1.084775 0.667282 -0.748424
C 0.543427 -1.270643 0.619507
C 0.318293 1.042868 -0.247150
C -3.734778 -1.692364 0.791494
C -3.582413 -0.768667 -1.563128
C -3.930231 0.755182 0.443438
C 2.589056 0.032147 0.021009
C 3.438255 -1.011345 0.509085
C 3.223618 1.252036 -0.375932
C 4.837925 -0.851216 0.558490
C 4.624374 1.398285 -0.320468
C 5.452477 0.350542 0.141196
H -0.807381 -1.970938 -0.936295
H -1.312151 -2.343782 0.748400
H -1.707679 1.579050 -0.770989
H -0.999177 0.281342 -1.790825
H 0.496278 -1.071567 1.715534
H 1.139253 -2.185954 0.467941
H 0.759633 1.725134 -0.992000
H 0.232266 1.600768 0.714907
H -3.363640 -1.619578 1.829260
H -3.451989 -2.674740 0.373256
H -4.836806 -1.643041 0.812479
H -3.096496 -1.685865 -1.943689
H -3.299791 0.078568 -2.210609
H -4.675560 -0.882806 -1.642778
H 3.019061 -1.958097 0.858937
H 2.634127 2.100902 -0.731619
H -2.351542 1.029301 1.736299
H -3.706106 2.188340 1.938549
H 5.451440 -1.678197 0.935236
H 5.069499 2.348317 -0.639099
H 6.539703 0.470539 0.184016


