%chk=000291587.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291587

0 1
O -0.672141 1.015717 2.080154
O -0.471672 -2.240181 -1.338119
O 1.607436 1.922744 -0.507641
O 3.236124 0.432694 -1.002954
N 0.972405 -1.606533 0.358895
N -2.980954 0.887885 0.503034
C 1.079151 -0.558248 1.402916
C -0.311201 0.138777 1.317566
C 2.220790 0.451291 1.222137
C -1.050728 -0.464323 0.230920
C -0.225067 -1.514091 -0.390375
C 2.130516 -2.416460 -0.049223
C -2.336737 -0.111101 -0.167848
C 2.441082 0.871988 -0.205966
C -3.032521 -0.787349 -1.296419
C -4.342270 1.347072 0.173409
C 1.662837 2.430584 -1.868517
H 1.189177 -1.045447 2.407434
H 3.171605 0.018707 1.604663
H 2.004398 1.346627 1.854845
H 1.803334 -3.160414 -0.802354
H 2.544700 -2.956301 0.816204
H 2.926566 -1.799380 -0.508905
H -3.939829 -1.317181 -0.974628
H -2.379231 -1.564774 -1.766914
H -3.305415 -0.095137 -2.104055
H -2.505349 1.367935 1.290590
H -4.646517 2.148784 0.869414
H -5.080248 0.528739 0.259963
H -4.397635 1.752956 -0.853135
H 1.102398 3.368014 -1.797814
H 1.175291 1.708789 -2.531457
H 2.702708 2.594316 -2.170518


%chk=000291587-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000291587

0 1
O -0.724438 1.070762 2.034724
O -0.424289 -2.279892 -1.447905
O 1.489047 1.811181 -0.566449
O 3.543539 0.738937 -0.779894
N 1.046140 -1.486616 0.227516
N -2.970233 0.867415 0.516996
C 1.065455 -0.525999 1.342736
C -0.324098 0.138413 1.244185
C 2.239328 0.497209 1.304024
C -1.042677 -0.478011 0.160477
C -0.175776 -1.502910 -0.471059
C 2.126760 -2.435555 -0.038285
C -2.360171 -0.116488 -0.203071
C 2.525315 1.004896 -0.099891
C -3.102725 -0.773972 -1.340847
C -4.328287 1.365840 0.283429
C 1.635739 2.305089 -1.958065
H 1.127156 -1.054821 2.318817
H 3.166185 0.034026 1.679685
H 1.958760 1.337003 1.965780
H 1.817694 -3.052427 -0.898519
H 2.303163 -3.098548 0.832072
H 3.067536 -1.913340 -0.291209
H -4.025934 -1.263942 -0.976539
H -2.455541 -1.529659 -1.812032
H -3.405406 -0.025928 -2.098070
H -2.383559 1.269557 1.282132
H -4.560973 2.129524 1.041949
H -5.080592 0.558835 0.363606
H -4.431160 1.829292 -0.716334
H 0.752116 2.936491 -2.124393
H 1.656965 1.454979 -2.660248
H 2.567964 2.885361 -2.060016


