%chk=000251553.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000251553

0 1
O 6.396846 0.902180 -0.969146
O -6.394536 -0.362250 0.824699
N 1.896879 -0.046153 0.026157
N -1.847413 -0.033081 -0.165328
N 4.740942 0.160565 0.416663
N -4.687630 0.048934 -0.635671
C 2.640910 1.099758 -0.593838
C 2.725385 -1.299119 0.099734
C -2.737317 -1.036048 0.520291
C -2.520686 1.288036 -0.376909
C 0.551247 -0.243825 -0.599115
C -0.502557 0.121902 0.473648
C 3.917341 1.380878 0.243690
C 3.984323 -0.988601 0.962870
C -4.011804 -1.238824 -0.347060
C -3.789888 1.057315 -1.244205
C 2.995587 0.916792 -2.075488
C 1.946586 -2.436551 0.769654
C -2.026886 -2.387315 0.660007
C -2.871459 2.054119 0.906653
C 5.915261 -0.016608 -0.324728
C -5.820353 0.431858 0.096109
H 1.969016 1.995231 -0.493705
H 3.055037 -1.630618 -0.919350
H -3.045677 -0.676918 1.537147
H -1.806488 1.910787 -0.981484
H 0.402202 0.387492 -1.500875
H 0.388782 -1.286598 -0.944877
H -0.377074 -0.532838 1.362019
H -0.317758 1.152533 0.844267
H 4.533313 2.172536 -0.245191
H 3.631488 1.753680 1.252524
H 3.669234 -0.731944 2.002106
H 4.631378 -1.885938 1.033533
H -3.747669 -1.717011 -1.316159
H -4.725299 -1.915944 0.179238
H -4.326130 2.013928 -1.407069
H -3.482440 0.681848 -2.249234
H 2.111897 0.708343 -2.686663
H 3.471028 1.818547 -2.481355
H 3.708353 0.099130 -2.232084
H 2.577649 -3.317662 0.924499
H 1.549545 -2.129876 1.746028
H 1.089268 -2.752061 0.160597
H -1.173938 -2.327597 1.347206
H -2.707655 -3.152051 1.051252
H -1.643314 -2.740499 -0.305339
H -3.295684 3.038139 0.683907
H -3.599434 1.514652 1.524138
H -1.985055 2.219585 1.530684
H 6.396734 -1.000455 -0.216155
H -6.185985 1.451116 -0.100590


%chk=000251553-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000251553

0 1
O 6.721993 0.931928 -0.929752
O -6.788790 -0.549681 0.162480
N 1.943705 -0.038292 -0.083072
N -1.889211 0.059343 -0.064316
N 4.765624 0.262106 0.188589
N -4.692253 0.246692 -0.542462
C 2.686001 0.921358 -0.967011
C 2.751315 -1.222541 0.329907
C -2.759158 -1.101623 0.297152
C -2.576855 1.385023 0.047044
C 0.559018 -0.313161 -0.555787
C -0.512986 0.066836 0.501936
C 3.949892 1.415857 -0.225462
C 4.057568 -0.728319 1.009611
C -4.038499 -1.070642 -0.578778
C -3.817342 1.378905 -0.879399
C 3.042021 0.367098 -2.374336
C 2.002619 -2.122303 1.331642
C -2.057104 -2.453985 0.069539
C -2.953565 1.805363 1.495585
C 6.082469 0.117229 -0.204941
C -6.014320 0.393810 -0.166995
H 2.021951 1.799170 -1.093080
H 3.035991 -1.846749 -0.554925
H -3.074232 -1.049427 1.369254
H -1.871982 2.134547 -0.364242
H 0.347163 0.296785 -1.454453
H 0.428558 -1.368569 -0.871421
H -0.425012 -0.590213 1.391274
H -0.262476 1.085312 0.855424
H 4.573634 2.054574 -0.873167
H 3.646163 1.988188 0.672912
H 3.780547 -0.272679 1.983340
H 4.727428 -1.586987 1.200979
H -3.752124 -1.307119 -1.624187
H -4.771005 -1.817345 -0.227404
H -4.383016 2.322601 -0.774517
H -3.474176 1.282018 -1.928664
H 2.153031 -0.063641 -2.869882
H 3.431371 1.176903 -3.017571
H 3.820332 -0.414085 -2.318339
H 2.657821 -2.952271 1.655479
H 1.704848 -1.542223 2.224278
H 1.098538 -2.573559 0.889338
H -1.180396 -2.582888 0.726661
H -2.758827 -3.278738 0.290752
H -1.727106 -2.547738 -0.981293
H -3.293299 2.857722 1.517603
H -3.766521 1.178453 1.902542
H -2.082980 1.719499 2.170454
H 6.535368 -0.820935 0.194028
H -6.335635 1.461892 -0.184645


