%chk=000246807.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246807

0 1
O -2.417373 0.671519 1.145978
O -1.914396 -0.312743 -0.870430
N 3.934553 0.927942 -0.279509
N -0.929592 -1.010910 1.131033
C 1.966737 -0.506926 0.160801
C 1.435635 -1.735333 0.905462
C 3.417777 -0.196113 0.568778
C -0.030544 -2.043378 0.537548
C 3.381620 2.247656 0.177049
C 5.435331 0.946900 -0.304526
C -0.450198 -3.422668 1.057731
C 3.506606 3.280767 -0.943864
C 5.958947 -0.187848 -1.186822
C -1.756891 -0.242797 0.332141
C -4.690251 0.750401 0.269282
C -3.399396 1.532047 0.489145
C -5.826834 1.675256 -0.181280
C -7.120377 0.898564 -0.414094
H 1.920115 -0.664479 -0.936819
H 1.319809 0.372517 0.352589
H 2.058507 -2.618889 0.660718
H 1.538937 -1.595993 1.998308
H 3.477669 0.017620 1.656682
H 4.049344 -1.094381 0.388271
H -0.157560 -2.010997 -0.581449
H 3.868779 2.623185 1.102215
H 2.302986 2.108026 0.420298
H 5.885052 0.883917 0.709496
H 5.761894 1.920203 -0.736692
H 0.132860 -4.217926 0.579367
H -1.507968 -3.622437 0.840202
H -0.318140 -3.521394 2.140291
H -0.888911 -0.845670 2.131716
H 2.966585 4.199293 -0.695135
H 3.090620 2.886848 -1.882148
H 4.550527 3.544643 -1.146078
H 7.035854 -0.091817 -1.354394
H 5.460820 -0.177955 -2.166629
H 5.770704 -1.172643 -0.745381
H -4.968850 0.216480 1.198867
H -4.516339 -0.043175 -0.488631
H -2.966983 1.915057 -0.452032
H -3.495767 2.339543 1.236951
H -5.997297 2.464831 0.576906
H -5.536547 2.201467 -1.112881
H -6.995783 0.131339 -1.187806
H -7.458072 0.391447 0.496948
H -7.928500 1.563302 -0.739575


%chk=000246807-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246807

0 1
O -2.427548 0.746784 0.945977
O -2.040429 -0.546688 -0.997286
N 4.065632 0.940550 -0.198911
N -0.865741 -0.900739 1.012501
C 2.043226 -0.543973 0.103957
C 1.464810 -1.756796 0.864177
C 3.500077 -0.236579 0.511151
C -0.029779 -2.030215 0.555102
C 3.594664 2.230886 0.375193
C 5.547809 0.878965 -0.320537
C -0.515058 -3.358928 1.180087
C 3.634771 3.391220 -0.637914
C 6.021919 -0.107838 -1.404931
C -1.790788 -0.277970 0.207987
C -4.848146 0.769457 0.333289
C -3.494842 1.483956 0.218218
C -5.978096 1.568006 -0.358943
C -7.349488 0.868258 -0.242057
H 2.015414 -0.728151 -0.986835
H 1.399982 0.338090 0.287671
H 2.040570 -2.669348 0.609364
H 1.586393 -1.611939 1.960222
H 3.557312 -0.110857 1.625033
H 4.124013 -1.117319 0.267711
H -0.172412 -2.075444 -0.540349
H 4.179856 2.505250 1.291012
H 2.548670 2.092963 0.704518
H 6.027646 0.624925 0.660087
H 5.906282 1.889404 -0.588718
H 0.070615 -4.209775 0.786561
H -1.579436 -3.532337 0.944392
H -0.400419 -3.347153 2.280993
H -0.796153 -0.584592 1.981672
H 3.252205 4.321028 -0.176317
H 3.011203 3.147404 -1.515373
H 4.660436 3.594265 -0.996203
H 7.125795 -0.101393 -1.478733
H 5.598279 0.175059 -2.384127
H 5.708010 -1.144814 -1.186587
H -5.094811 0.623390 1.403290
H -4.765319 -0.232849 -0.128221
H -3.195147 1.590066 -0.840429
H -3.514393 2.472877 0.707351
H -6.041201 2.582690 0.085223
H -5.725732 1.708482 -1.429448
H -7.321558 -0.134198 -0.708414
H -7.639303 0.737893 0.817611
H -8.144091 1.452325 -0.741420


