%chk=000299099.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299099

0 1
O -0.845123 -1.466152 0.337984
O 0.856986 -0.413071 1.788216
O 0.371960 -1.511059 -1.572874
N -4.707698 0.263359 0.480509
C -3.122993 -1.355702 -0.576335
C -3.522173 -0.617136 0.736999
C -1.911023 -2.272991 -0.260072
C -4.262083 -2.268193 -1.055563
C -2.742133 -0.356193 -1.673543
C 1.147357 -0.198848 0.401446
C 0.234483 -1.135462 -0.435329
C -5.852953 -0.098948 1.367227
C -4.357826 1.704897 0.648267
C 2.618682 -0.538161 0.235759
C 0.863727 1.248329 0.019384
C 3.157848 -0.771716 -1.037051
C 0.637332 1.615068 -1.314038
C 3.444819 -0.586425 1.367496
C 0.863805 2.225167 1.024213
C 4.520046 -1.050396 -1.173393
C 0.395588 2.953449 -1.635125
C 4.806303 -0.866865 1.224147
C 0.621079 3.561946 0.697959
C 5.345755 -1.096955 -0.045247
C 0.384397 3.927352 -0.631110
H -3.729852 -1.369700 1.525306
H -2.640486 -0.045124 1.098097
H -2.116835 -3.008681 0.534804
H -1.527817 -2.782967 -1.161702
H -5.158761 -1.664341 -1.263531
H -4.005701 -2.793173 -1.980665
H -4.544215 -3.011983 -0.306024
H -3.609210 0.260643 -1.947491
H -1.948684 0.323707 -1.345782
H -2.392482 -0.859315 -2.581266
H -5.668304 0.029172 2.443487
H -6.724024 0.517772 1.092586
H -6.130433 -1.148973 1.181844
H -3.530123 1.955971 -0.035288
H -5.222753 2.317236 0.346672
H -4.067116 1.998120 1.667217
H 2.514790 -0.751939 -1.920728
H 0.653812 0.862553 -2.106280
H 3.017082 -0.411411 2.357699
H 1.063602 1.934497 2.057945
H -0.119060 -0.378519 1.951822
H 4.937209 -1.233528 -2.162233
H 0.218939 3.237255 -2.671770
H 5.445996 -0.906044 2.103948
H 0.622423 4.319620 1.479934
H 6.406715 -1.313780 -0.155529
H 0.196723 4.969335 -0.884996


%chk=000299099-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000299099

0 1
O -0.830416 -1.229916 0.448818
O 0.950451 -0.048184 1.877058
O 0.505523 -1.474902 -1.451418
N -4.995580 0.107572 0.621986
C -3.170694 -1.303643 -0.469026
C -3.741189 -0.654330 0.835837
C -1.899488 -2.111440 -0.123096
C -4.199298 -2.309753 -1.047030
C -2.859725 -0.214571 -1.522966
C 1.263258 -0.020872 0.445385
C 0.315808 -0.996226 -0.316130
C -6.178992 -0.458801 1.295842
C -4.868438 1.563331 0.826253
C 2.728630 -0.483729 0.288222
C 1.050558 1.415260 -0.112571
C 3.407226 -0.335797 -0.945912
C 0.688323 1.677145 -1.457298
C 3.398746 -1.079600 1.383178
C 1.270629 2.502586 0.769703
C 4.739102 -0.782791 -1.082892
C 0.545227 3.009283 -1.909344
C 4.734611 -1.520252 1.245182
C 1.131311 3.831037 0.314199
C 5.409304 -1.376103 0.012069
C 0.766872 4.090716 -1.027952
H -3.912312 -1.462698 1.580681
H -2.961139 0.008212 1.264978
H -2.095629 -2.854446 0.670657
H -1.485006 -2.608506 -1.018401
H -5.146473 -1.776940 -1.240498
H -3.844347 -2.744646 -1.999811
H -4.402920 -3.140576 -0.343197
H -3.790503 0.324303 -1.771572
H -2.123393 0.519752 -1.147419
H -2.454035 -0.662944 -2.448706
H -6.138188 -0.380555 2.412320
H -7.089163 0.068336 0.954839
H -6.290114 -1.525265 1.033693
H -4.022645 1.955352 0.236375
H -5.787328 2.069644 0.477081
H -4.705453 1.850604 1.896080
H 2.903244 0.126811 -1.799439
H 0.516531 0.850606 -2.155777
H 2.867571 -1.179107 2.332845
H 1.543505 2.289008 1.807411
H -0.026989 -0.205221 1.961369
H 5.253785 -0.665445 -2.043156
H 0.260824 3.198486 -2.950608
H 5.246087 -1.975551 2.100981
H 1.307920 4.663137 1.005284
H 6.444723 -1.719020 -0.095278
H 0.657281 5.122344 -1.380825


