%chk=000258970.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258970

0 1
O -4.540793 0.877596 1.122830
N -1.876217 -0.455773 0.165710
N 0.994983 -0.145859 -0.132912
N -4.432180 1.433890 -1.060245
C -1.002559 -1.599105 -0.264320
C -1.277258 0.833164 -0.317270
C 0.401246 -1.431308 0.349438
C 0.132500 1.002443 0.285171
C -3.280383 -0.648983 -0.340997
C 2.406337 0.012879 -0.019713
C -3.931879 -1.841387 0.366586
C -4.121831 0.594848 0.019278
C 3.256468 -1.117839 0.001800
C 2.989534 1.301446 -0.055744
C 4.640083 -0.954460 -0.020793
C 4.375520 1.442586 -0.077755
C 5.210878 0.321393 -0.057895
H -0.920575 -1.687514 -1.369965
H -1.448472 -2.545397 0.114881
H -1.907681 1.676407 0.044678
H -1.224060 0.900141 -1.425050
H 0.335851 -1.460093 1.460970
H 1.043385 -2.283291 0.030106
H 0.573610 1.955368 -0.086000
H 0.061177 1.077257 1.394579
H -3.304217 -0.821977 -1.449339
H -3.415362 -2.782603 0.151327
H -3.908939 -1.696236 1.460870
H -4.982239 -1.955510 0.076515
H 2.835947 -2.121000 0.022272
H 2.360444 2.188822 -0.079617
H 5.283326 -1.834232 -0.007475
H 4.811585 2.441025 -0.108887
H -4.162153 1.253605 -2.007455
H -5.018328 2.241012 -0.909403
H 6.289654 0.440185 -0.071776


%chk=000258970-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000258970

0 1
O -4.219967 1.179278 1.135206
N -1.863980 -0.407601 0.129792
N 1.026544 -0.141492 -0.042907
N -4.746818 1.220160 -1.122997
C -1.002267 -1.589272 -0.119086
C -1.233095 0.797373 -0.463167
C 0.392425 -1.369358 0.488323
C 0.166748 1.045055 0.125794
C -3.267674 -0.593418 -0.319112
C 2.437309 0.001259 -0.006227
C -3.967542 -1.769650 0.401913
C -4.095886 0.684896 -0.019845
C 3.292556 -1.111599 -0.278515
C 3.058152 1.260671 0.258338
C 4.692964 -0.965302 -0.289289
C 4.462785 1.396411 0.233689
C 5.297235 0.289708 -0.037320
H -0.896882 -1.795384 -1.216368
H -1.447188 -2.477834 0.359219
H -1.860025 1.678074 -0.240047
H -1.143128 0.701598 -1.576819
H 0.285995 -1.296507 1.594853
H 1.019697 -2.246232 0.266529
H 0.614506 1.897850 -0.412863
H 0.063313 1.324032 1.199632
H -3.304901 -0.779125 -1.429202
H -3.530482 -2.744352 0.126669
H -3.886308 -1.625309 1.492108
H -5.038408 -1.797886 0.132074
H 2.863941 -2.091163 -0.513525
H 2.451813 2.135758 0.509179
H 5.317713 -1.839203 -0.509114
H 4.905462 2.377364 0.443889
H -4.626180 0.837927 -2.059409
H -5.357614 2.025968 -0.986924
H 6.386591 0.398808 -0.050074


