%chk=000190342.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000190342

0 1
O 0.376969 -2.164463 0.196333
O 5.199047 -2.770531 -0.646080
O -0.709149 -3.882406 -0.743540
O 2.972958 -2.747911 -0.742089
N -5.537840 0.044773 0.474389
N 3.699290 3.532422 -0.780848
C -3.208190 -0.257073 -0.303368
C 2.150637 1.675970 -0.239929
C -3.440298 -1.680688 -0.727423
C 3.275873 0.679395 -0.148414
C -1.630951 1.600362 -0.069489
C -0.258878 2.114818 -0.237785
C -3.192679 -2.679195 0.415794
C 3.091482 -0.324436 0.998761
C -1.947174 0.305338 -0.513912
C 0.831179 1.240051 -0.095587
C -4.207246 0.524414 0.330743
C 2.385063 3.043868 -0.533717
C -2.627977 2.361699 0.559993
C -0.011700 3.462737 -0.541897
C -1.791487 -2.566634 1.028121
C 4.154508 -1.426400 0.979081
C -3.903543 1.835502 0.753011
C 1.294344 3.925964 -0.679912
C -0.722305 -2.980133 0.059363
C 3.975271 -2.345211 -0.190055
H -2.779775 -1.934174 -1.586136
H -4.465975 -1.813093 -1.128575
H 3.333128 0.142621 -1.122434
H 4.257233 1.184645 -0.038998
H -3.940820 -2.530539 1.217896
H -3.345318 -3.710591 0.031547
H 3.125355 0.206302 1.970725
H 2.075054 -0.783808 0.947075
H -1.181802 -0.283835 -1.026676
H 0.642882 0.182755 0.133549
H -2.404587 3.368013 0.912405
H -0.844157 4.151802 -0.681066
H -1.714033 -3.209726 1.931200
H -1.604317 -1.527060 1.385472
H 4.098295 -2.029160 1.914416
H 5.180238 -0.993503 0.974010
H -4.668992 2.444296 1.227992
H 1.470718 4.971223 -0.923135
H -6.087774 0.504357 1.187057
H -5.637964 -0.959232 0.525038
H 3.817796 4.528072 -0.648925
H 4.441879 3.013993 -0.326195
H 1.157762 -2.447808 -0.395466
H 5.129268 -3.399084 -1.417520


%chk=000190342-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000190342

0 1
O 0.355817 -2.471954 0.930832
O 5.046660 -3.036326 -0.709960
O -0.736848 -3.529555 -0.826685
O 2.843119 -2.818594 -0.093369
N -5.554328 -0.069612 0.475359
N 3.749041 3.605444 -0.485657
C -3.254812 -0.273487 -0.395368
C 2.169383 1.696485 -0.419043
C -3.468249 -1.710068 -0.849599
C 3.257814 0.630181 -0.492649
C -1.660068 1.621512 -0.086887
C -0.275917 2.150093 -0.213334
C -3.346372 -2.758414 0.301624
C 3.504426 -0.060269 0.877431
C -1.991575 0.326857 -0.571041
C 0.829907 1.266009 -0.311256
C -4.280754 0.475639 0.266650
C 2.443039 3.100625 -0.412949
C -2.698966 2.345576 0.559400
C 0.020173 3.541795 -0.226625
C -2.030403 -2.663030 1.103093
C 4.524570 -1.219675 0.793542
C -3.982506 1.791900 0.721095
C 1.343843 4.004580 -0.320725
C -0.778482 -2.942061 0.282672
C 4.023231 -2.396033 -0.018366
H -2.715819 -1.965402 -1.616731
H -4.457220 -1.840534 -1.337462
H 2.946256 -0.142324 -1.223644
H 4.218036 1.032543 -0.873533
H -4.182870 -2.635692 1.017624
H -3.433780 -3.768387 -0.141491
H 3.871514 0.684882 1.607635
H 2.542904 -0.440225 1.267865
H -1.235653 -0.246188 -1.121532
H 0.649582 0.184771 -0.270908
H -2.497281 3.340708 0.972528
H -0.794690 4.273854 -0.188587
H -2.041481 -3.398026 1.933384
H -1.918221 -1.670841 1.573485
H 4.736772 -1.604027 1.812191
H 5.490003 -0.891137 0.370763
H -4.762282 2.372803 1.230864
H 1.539511 5.084736 -0.334976
H -6.289997 0.491984 0.893374
H -5.796470 -0.985114 0.111145
H 3.904518 4.608309 -0.519597
H 4.547843 2.993635 -0.611867
H 1.219232 -2.669872 0.441966
H 4.679151 -3.819377 -1.205882


