%chk=000296889.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296889

0 1
O 0.079893 -1.142897 -0.897366
N 0.863432 0.653210 0.237098
C -1.634540 0.454175 -0.319838
C -2.588994 -0.697663 -0.849690
C -3.332260 -0.361650 1.267056
C -2.171164 0.675291 1.132916
C -2.752891 -1.558410 0.445324
C -3.993201 -0.096517 -0.943544
C -4.436013 0.103906 0.311929
C -1.708849 1.693039 -1.206223
C -0.188757 -0.085518 -0.348345
C 2.232649 0.192695 0.139616
C 0.642393 1.921963 0.970956
C 2.541023 -1.158105 0.384569
C 3.252131 1.103025 -0.195411
C 3.867900 -1.583304 0.309783
C 4.574853 0.659518 -0.258456
C 4.888325 -0.678539 -0.002742
H -2.211389 -1.213859 -1.738018
H -3.640277 -0.570120 2.293724
H -2.532942 1.702307 1.281779
H -1.401874 0.486699 1.897052
H -1.812224 -1.968860 0.829953
H -3.451413 -2.394531 0.327617
H -4.467761 0.103309 -1.881814
H -5.361341 0.512636 0.659253
H -1.049992 2.499216 -0.851913
H -1.420951 1.459871 -2.239970
H -2.728082 2.099575 -1.240267
H 1.594766 2.402520 1.249132
H 0.087486 1.733323 1.907885
H 0.066118 2.639544 0.353339
H 1.743471 -1.871456 0.599277
H 3.017559 2.139952 -0.422106
H 4.107419 -2.630144 0.494715
H 5.365486 1.362874 -0.516413
H 5.920212 -1.017277 -0.054759


%chk=000296889-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000296889

0 1
O 0.062864 -1.124154 -1.091803
N 0.862410 0.658638 0.176931
C -1.651589 0.476374 -0.351640
C -2.625737 -0.690571 -0.853102
C -3.319313 -0.390496 1.291436
C -2.158928 0.671478 1.141534
C -2.732304 -1.557663 0.439129
C -4.043383 -0.109850 -0.907326
C -4.464373 0.067005 0.379343
C -1.793308 1.731041 -1.258228
C -0.186131 -0.060975 -0.445784
C 2.224948 0.162841 0.137024
C 0.695977 2.005226 0.770857
C 2.516076 -1.220897 0.276827
C 3.301071 1.081752 0.017609
C 3.854591 -1.663516 0.293384
C 4.638504 0.628444 0.036154
C 4.925420 -0.747059 0.173113
H -2.249213 -1.185377 -1.756991
H -3.585471 -0.607779 2.337623
H -2.524574 1.698360 1.324376
H -1.366061 0.446164 1.878085
H -1.757555 -1.931974 0.797329
H -3.437181 -2.398184 0.327692
H -4.569434 0.173910 -1.822846
H -5.397090 0.523925 0.722149
H -1.131843 2.561233 -0.959494
H -1.554751 1.471499 -2.306315
H -2.832427 2.100827 -1.222801
H 0.966596 2.807132 0.056485
H 1.348753 2.093966 1.655847
H -0.339039 2.167781 1.089253
H 1.701627 -1.941711 0.357760
H 3.105809 2.151431 -0.105663
H 4.059755 -2.734210 0.404163
H 5.453142 1.354776 -0.062165
H 5.962366 -1.099590 0.186155


