%chk=000218576.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000218576

1 1
O -5.807445 -0.557480 -0.633718
N -3.254462 0.162150 0.374670
N 1.460820 -0.984639 -0.095746
N 2.017727 1.798879 -0.190769
C -3.718603 -1.255369 0.413970
C -4.389448 1.130713 0.409404
C -1.957330 0.520016 0.199621
C 0.415594 -0.071197 -0.005904
C -4.724634 -1.497294 -0.727304
C -5.373814 0.809278 -0.730734
C -0.920587 -0.447138 0.127146
C 0.775442 1.357867 -0.073583
C 2.796121 -0.535925 -0.201755
C -1.596550 1.939606 0.121910
C 1.182509 -2.458240 -0.011101
C -0.313661 2.333249 -0.004441
C 3.041039 0.874838 -0.254532
C 3.898819 -1.431235 -0.267209
C 1.205921 -2.931241 1.433002
C 4.385194 1.356206 -0.375045
C 5.180598 -0.934402 -0.382820
C 5.427553 0.464575 -0.437228
H -2.866337 -1.968021 0.348380
H -4.213582 -1.432012 1.401556
H -4.904334 1.027247 1.397531
H -4.037337 2.185285 0.341273
H -5.245583 -2.470349 -0.619343
H -4.254593 -1.430827 -1.724319
H -6.326070 1.368282 -0.623471
H -4.939454 0.996124 -1.728661
H -1.185772 -1.505348 0.183347
H -2.402727 2.682695 0.170886
H 1.938438 -3.007319 -0.625009
H 0.195414 -2.669064 -0.489001
H -0.026316 3.393292 -0.062574
H 3.735136 -2.510764 -0.226276
H 2.180246 -2.765914 1.916252
H 1.004507 -4.012011 1.496168
H 0.454281 -2.428437 2.057216
H 4.544145 2.440555 -0.414731
H 6.032874 -1.621691 -0.433752
H 6.459561 0.817457 -0.529305


%chk=000218576-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000218576

1 1
O -5.947765 -0.566135 -0.541737
N -3.273056 0.161479 0.331584
N 1.502876 -0.976779 -0.097843
N 2.057632 1.815563 -0.285929
C -3.756123 -1.244111 0.405586
C -4.419005 1.107521 0.453147
C -1.953624 0.527819 0.166927
C 0.445130 -0.058138 -0.030074
C -4.826233 -1.495938 -0.686764
C -5.471966 0.817190 -0.642306
C -0.898637 -0.439812 0.142440
C 0.794700 1.360687 -0.154080
C 2.836941 -0.535583 -0.173154
C -1.593195 1.934696 0.021315
C 1.213169 -2.443330 -0.068362
C -0.280454 2.321307 -0.127549
C 3.081992 0.891526 -0.282657
C 3.949596 -1.421886 -0.150311
C 1.172112 -3.014930 1.363264
C 4.422130 1.377936 -0.390259
C 5.252377 -0.909824 -0.254033
C 5.498673 0.490424 -0.380416
H -2.936534 -1.964312 0.280549
H -4.211212 -1.403735 1.401824
H -4.883927 0.948885 1.445249
H -4.095118 2.154222 0.395079
H -5.254656 -2.504234 -0.572933
H -4.368927 -1.398216 -1.694463
H -6.360096 1.451330 -0.494909
H -5.042600 1.007657 -1.648763
H -1.136684 -1.490517 0.295766
H -2.361739 2.708585 0.025975
H 1.978533 -2.950815 -0.675282
H 0.257718 -2.605835 -0.593206
H -0.001979 3.373500 -0.231641
H 3.819962 -2.500050 -0.036172
H 2.141338 -2.889520 1.875282
H 0.945255 -4.094447 1.323823
H 0.398907 -2.523201 1.978343
H 4.555035 2.459915 -0.475744
H 6.097789 -1.605111 -0.231583
H 6.524964 0.858615 -0.461981


