%chk=000299905.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299905

0 1
O 2.030214 -3.277990 0.945323
N 3.305874 -0.322562 -0.647422
N -0.836237 -1.439538 -0.350692
N 3.971085 -2.031537 0.849792
N -3.189502 0.221355 -0.315443
N -4.201268 -1.256599 1.121429
C 2.065596 -1.081466 -0.242981
C 1.108098 -0.281179 0.660309
C 1.347674 -1.582927 -1.509575
C -0.172804 -1.077868 0.948062
C 0.056719 -2.336446 -1.158941
C 2.627783 -2.293931 0.563257
C 4.480912 -0.823952 0.148838
C 3.245706 1.077325 -0.931999
C -2.155629 -2.106979 -0.095137
C 4.912864 -3.033442 1.373660
C -3.176011 -1.072554 0.265503
C 4.246567 1.966863 -0.489916
C 2.219294 1.558878 -1.776155
C 4.217370 3.303823 -0.893151
C 2.205330 2.896049 -2.163340
C -4.293938 0.896303 0.233639
C 3.201373 3.777232 -1.725717
C -4.923830 -0.045573 1.125060
C -4.806031 2.191836 0.047141
C -6.083770 0.325364 1.831512
C -5.947212 2.524244 0.758613
C -6.577221 1.604416 1.637950
H 0.839319 0.678213 0.170798
H 1.602166 -0.007415 1.611717
H 2.017916 -2.230607 -2.106375
H 1.109987 -0.709056 -2.160169
H 0.068017 -1.973618 1.568246
H -0.877369 -0.452580 1.539255
H -0.474378 -2.612586 -2.094644
H 0.307947 -3.284559 -0.624844
H 5.302811 -1.068237 -0.565892
H 4.854983 -0.086817 0.900958
H -2.121173 -2.887510 0.704744
H -2.495223 -2.630975 -1.021515
H 5.565951 -3.444393 0.585978
H 4.341099 -3.873728 1.818189
H 5.537940 -2.589350 2.166359
H 5.045130 1.631556 0.167047
H 1.446277 0.875986 -2.141034
H -2.489819 0.596786 -0.931465
H 4.997393 3.983082 -0.548540
H 1.412099 3.258338 -2.817554
H 3.183907 4.819134 -2.033670
H -4.324661 2.893052 -0.625859
H -6.559590 -0.387259 2.502434
H -6.382590 3.516669 0.647879
H -7.472343 1.925228 2.168639


%chk=000299905-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000299905

0 1
O 2.146489 -3.336688 1.028571
N 3.207745 -0.144910 -0.258641
N -0.876023 -1.496675 -0.314564
N 4.072139 -2.014760 0.768762
N -3.120112 0.228684 -0.175640
N -4.401394 -1.361802 0.846159
C 2.044724 -1.054454 -0.031387
C 0.994458 -0.441829 0.951850
C 1.379073 -1.518078 -1.368457
C -0.297169 -1.276404 1.044228
C 0.066614 -2.295848 -1.147659
C 2.719813 -2.275669 0.646539
C 4.471939 -0.712752 0.240343
C 3.206382 1.132766 -0.842033
C -2.223182 -2.124517 -0.236618
C 5.029385 -2.944113 1.362482
C -3.258753 -1.116094 0.182778
C 4.435669 1.858456 -0.953316
C 2.024063 1.764847 -1.342956
C 4.474839 3.142073 -1.534034
C 2.081709 3.048219 -1.920630
C -4.249253 0.912982 0.293323
C 3.301481 3.755185 -2.025621
C -5.049407 -0.103731 0.927489
C -4.649524 2.263878 0.239468
C -6.285560 0.240225 1.519256
C -5.888225 2.584530 0.836773
C -6.693204 1.589625 1.465683
H 0.740799 0.578642 0.619389
H 1.449374 -0.351045 1.956105
H 2.094421 -2.149692 -1.928007
H 1.169571 -0.634175 -1.993393
H -0.088540 -2.249306 1.544043
H -1.038602 -0.732107 1.657640
H -0.407420 -2.482840 -2.129739
H 0.286171 -3.280165 -0.675590
H 5.226612 -0.827801 -0.571166
H 4.926835 -0.082044 1.038574
H -2.271714 -2.990553 0.461347
H -2.477808 -2.508887 -1.244353
H 5.798668 -3.250153 0.628355
H 4.468456 -3.835503 1.687608
H 5.532197 -2.494240 2.239353
H 5.371913 1.426544 -0.587111
H 1.055106 1.264483 -1.289381
H -2.286879 0.584251 -0.645522
H 5.436137 3.664878 -1.599991
H 1.155075 3.499658 -2.294207
H 3.335532 4.752147 -2.475869
H -4.039035 3.034978 -0.242181
H -6.898677 -0.527533 2.000918
H -6.240216 3.622005 0.815976
H -7.647889 1.883812 1.915352


