%chk=000288843.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000288843

0 1
O -5.029398 -2.099988 1.413005
O -3.233065 -1.268925 2.271036
N -0.089973 0.485995 0.446139
N 2.428688 1.814060 0.037902
N -3.942565 -1.554001 1.313810
C 1.155021 -0.178305 0.923227
C 1.313540 -1.647213 0.440994
C 2.380592 0.555355 0.321101
C 2.775759 -1.754229 0.090758
C 3.392879 -0.472574 0.037025
C -0.045167 1.912737 0.402145
C -1.345242 -0.167359 0.898364
C 1.220448 2.557692 0.209057
C 3.514415 -2.898148 -0.168533
C 4.737235 -0.336211 -0.278618
C -2.226190 -0.568499 -0.263150
C -1.207923 2.702122 0.431694
C 1.290298 3.951852 0.094206
C 4.879152 -2.758031 -0.482675
C 5.481684 -1.500762 -0.536716
C -1.114202 4.090974 0.313221
C -3.458128 -1.223264 -0.037473
C 0.124163 4.718473 0.155555
C -1.854320 -0.306914 -1.592587
C -4.288071 -1.594816 -1.116520
C -2.674995 -0.675272 -2.656512
C -3.897678 -1.321579 -2.421094
H 1.232631 -0.142315 2.041638
H 0.683648 -1.850564 -0.448897
H 1.012467 -2.372368 1.215122
H -1.928577 0.488822 1.598597
H -1.117435 -1.077029 1.512890
H 3.058385 -3.883928 -0.132515
H 5.198456 0.650555 -0.326324
H -2.188110 2.244151 0.543852
H 2.263660 4.425929 -0.049431
H 5.470842 -3.650409 -0.686915
H 6.538954 -1.414917 -0.782867
H -2.024136 4.690955 0.347038
H 0.182188 5.801356 0.072826
H -0.902552 0.199562 -1.793746
H -5.240020 -2.099322 -0.909868
H -2.364833 -0.458417 -3.681184
H -4.536726 -1.606329 -3.256677


%chk=000288843-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000288843

0 1
O -5.396011 -1.673457 1.307597
O -3.313922 -1.593683 2.220944
N -0.055324 0.383826 0.570149
N 2.358714 1.764992 -0.132969
N -4.124076 -1.472609 1.216621
C 1.237727 -0.200878 0.997369
C 1.444324 -1.712603 0.685281
C 2.372695 0.501205 0.222422
C 2.909360 -1.788331 0.261349
C 3.414026 -0.492164 -0.046879
C -0.079485 1.792460 0.422169
C -1.282960 -0.334641 0.940903
C 1.156170 2.478489 0.120974
C 3.728054 -2.921833 0.101560
C 4.729771 -0.314565 -0.534604
C -2.236577 -0.585435 -0.237305
C -1.275206 2.555693 0.500080
C 1.160150 3.883888 -0.040208
C 5.052027 -2.747138 -0.372678
C 5.547000 -1.454529 -0.691589
C -1.243059 3.958512 0.344413
C -3.561180 -1.098670 -0.105016
C -0.026238 4.633748 0.086050
C -1.807025 -0.290166 -1.555241
C -4.413317 -1.300162 -1.218274
C -2.637094 -0.498866 -2.676068
C -3.948858 -1.002863 -2.510781
H 1.403502 -0.033114 2.090194
H 0.788380 -2.011168 -0.157877
H 1.212472 -2.369181 1.541809
H -1.822364 0.189172 1.756117
H -1.005088 -1.307988 1.377150
H 3.353278 -3.924766 0.335506
H 5.094374 0.689720 -0.771753
H -2.235907 2.065772 0.682491
H 2.116955 4.358144 -0.281108
H 5.703487 -3.619622 -0.496367
H 6.573800 -1.345250 -1.057668
H -2.178074 4.524314 0.424419
H -0.009906 5.721715 -0.032501
H -0.799010 0.114452 -1.681334
H -5.419680 -1.688922 -1.042722
H -2.261414 -0.261647 -3.677058
H -4.598692 -1.162952 -3.376669


