%chk=000270038.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270038

0 1
O -2.888990 1.721928 -1.166253
N 5.079583 -0.302048 -0.135267
N -1.398222 -0.416437 0.146611
C 3.674775 -0.078142 -0.122291
C 0.866161 0.220233 -0.326238
C 3.112185 0.998522 -0.852086
C 2.802020 -0.997220 0.508021
C 1.732729 1.135424 -0.951628
C 1.423712 -0.847365 0.400525
C 5.946007 0.880157 -0.396039
C 5.633489 -1.161352 0.946777
C -0.589479 0.408319 -0.452443
C -2.811921 -0.309555 0.080352
C -3.583545 0.711083 -0.537890
C -3.519018 -1.346667 0.723865
C -4.984582 0.702944 -0.516473
C -4.914367 -1.363353 0.747097
C -5.645244 -0.342855 0.130082
H 3.754534 1.718226 -1.353332
H 3.199024 -1.838084 1.071478
H 1.320732 1.968691 -1.522508
H 0.758055 -1.565742 0.888750
H 5.655242 1.348283 -1.353472
H 6.992432 0.551622 -0.506516
H 5.900347 1.644698 0.395267
H 6.700879 -1.355668 0.752210
H 5.123431 -2.141432 0.937604
H 5.534050 -0.724977 1.953022
H -0.890420 1.272282 -1.074212
H -2.948844 -2.143822 1.208497
H -5.547867 1.497129 -0.996361
H -5.434813 -2.176246 1.249764
H -6.734268 -0.361700 0.152713
H -3.497406 2.399225 -1.553326


%chk=000270038-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000270038

0 1
O -2.989914 1.760081 -1.271589
N 5.104883 -0.146612 0.128662
N -1.425020 -0.364075 0.147538
C 3.722054 0.002827 -0.000882
C 0.867346 0.306103 -0.259399
C 3.158084 1.095429 -0.737623
C 2.814591 -0.934758 0.601503
C 1.766232 1.233446 -0.857484
C 1.429591 -0.780641 0.472047
C 6.011556 0.826916 -0.492811
C 5.658008 -1.272528 0.893077
C -0.578185 0.486287 -0.404676
C -2.832541 -0.280333 0.070232
C -3.640706 0.708216 -0.590691
C -3.534817 -1.322880 0.744572
C -5.052054 0.637319 -0.564557
C -4.940323 -1.400205 0.774474
C -5.707845 -0.412122 0.114702
H 3.807780 1.834713 -1.214398
H 3.201594 -1.784610 1.171194
H 1.359627 2.079785 -1.426583
H 0.738948 -1.495051 0.932318
H 5.882581 0.864220 -1.593669
H 7.054769 0.542612 -0.283725
H 5.850580 1.850147 -0.096148
H 6.757773 -1.214020 0.887198
H 5.366487 -2.249359 0.456760
H 5.321862 -1.257432 1.949668
H -0.905499 1.360553 -0.992031
H -2.912839 -2.071400 1.245591
H -5.640826 1.409587 -1.079981
H -5.434119 -2.220494 1.305622
H -6.802197 -0.453657 0.125942
H -3.657059 2.368040 -1.678553


