%chk=000215869.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215869

0 1
O 1.335939 2.735501 0.566238
N -0.699358 1.053576 -1.936758
N -3.320120 0.569482 -1.014009
C -0.050108 0.029094 -1.036878
C 0.317292 0.562640 0.372411
C 2.718615 0.966249 -0.329423
C 1.209751 -0.481016 -1.783698
C 2.368911 0.522415 -1.767445
C 1.449187 1.574758 0.253530
C 0.754620 -0.559401 1.330703
C 3.150381 -0.208911 0.512384
C 2.209584 -0.942519 1.262695
C -1.622635 0.400756 -2.910688
C -1.391465 2.210199 -1.301837
C -2.983348 -0.059931 -2.325265
C -2.896812 1.998069 -1.001803
C 4.499775 -0.589423 0.520716
C 2.641167 -2.053609 2.004697
C 4.917628 -1.694726 1.264772
C -3.101737 -0.191395 0.174449
C 3.985975 -2.428876 2.005240
C -3.065859 -1.604932 0.134637
C -3.050184 0.450501 1.435031
C -2.982055 -2.340728 1.315097
C -2.966740 -0.301946 2.604013
C -2.924003 -1.699333 2.555617
H -0.734408 -0.848541 -0.878233
H -0.584155 1.058245 0.819357
H 3.523541 1.740660 -0.360329
H 0.953770 -0.723313 -2.832982
H 1.533109 -1.432787 -1.316591
H 3.261493 0.078617 -2.245652
H 2.096274 1.414551 -2.368817
H 0.116802 -1.454658 1.162632
H 0.526732 -0.238464 2.372820
H -1.798373 1.138922 -3.725851
H -1.103483 -0.457750 -3.385551
H -0.856863 2.542149 -0.385370
H -1.278938 3.057645 -2.019092
H -3.804444 0.217899 -3.025259
H -3.016249 -1.169000 -2.245069
H -3.166839 2.463781 -0.028153
H -3.514028 2.518742 -1.769010
H 5.226936 -0.020687 -0.056867
H 1.922996 -2.628033 2.587654
H 5.966812 -1.983248 1.267979
H 4.308733 -3.291910 2.584565
H -3.123008 -2.125929 -0.820602
H -3.095605 1.537263 1.497868
H -2.962670 -3.429537 1.267316
H -2.934449 0.206999 3.567728
H -2.857887 -2.278311 3.471487


%chk=000215869-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000215869

0 1
O 1.534335 2.799471 0.597610
N -0.591524 1.047556 -1.787393
N -3.107914 0.466197 -0.958285
C 0.083061 0.003538 -0.943715
C 0.559413 0.544809 0.445360
C 2.876653 1.027088 -0.458247
C 1.300226 -0.558461 -1.733068
C 2.423636 0.490560 -1.864372
C 1.645514 1.597826 0.237274
C 1.119450 -0.598835 1.351759
C 3.457610 -0.110345 0.384140
C 2.605190 -0.915269 1.189197
C -1.466566 0.463907 -2.829879
C -1.305567 2.201859 -1.174820
C -2.740352 -0.224838 -2.208661
C -2.842928 1.912191 -0.998202
C 4.843152 -0.399938 0.323247
C 3.163494 -2.007289 1.901168
C 5.389034 -1.487300 1.037397
C -3.453695 -0.233804 0.210344
C 4.541381 -2.299658 1.827593
C -3.936613 -1.579540 0.139628
C -3.340460 0.359145 1.508911
C -4.268862 -2.293025 1.309232
C -3.691895 -0.362681 2.667226
C -4.153137 -1.697662 2.586510
H -0.615523 -0.836804 -0.717208
H -0.295383 0.995044 0.976774
H 3.622452 1.831081 -0.590490
H 0.978087 -0.877005 -2.741861
H 1.678719 -1.465541 -1.225705
H 3.301457 0.057154 -2.379740
H 2.053688 1.341515 -2.465702
H 0.512396 -1.513066 1.195251
H 0.946891 -0.301703 2.405261
H -1.767305 1.280191 -3.513995
H -0.917191 -0.275094 -3.438609
H -0.832352 2.484399 -0.224755
H -1.187749 3.073788 -1.850622
H -3.569320 -0.220894 -2.951058
H -2.509473 -1.279070 -1.975488
H -3.246830 2.403190 -0.099641
H -3.396805 2.336510 -1.861412
H 5.494703 0.234150 -0.290553
H 2.508504 -2.630113 2.523670
H 6.462509 -1.699162 0.981405
H 4.953386 -3.148022 2.385290
H -4.092226 -2.055790 -0.833844
H -2.961511 1.380232 1.621172
H -4.641339 -3.320238 1.216378
H -3.591270 0.123132 3.645181
H -4.420952 -2.253587 3.490753


