%chk=000209286.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000209286

0 1
O 1.898234 -1.802211 -2.526608
O -3.765533 -0.520425 0.416811
N 4.432335 0.047853 -0.828397
N 1.641432 -0.050061 -1.044238
N -2.213309 1.185246 1.759404
C 6.523365 0.345991 1.204952
C 6.192405 1.462049 0.206809
C 5.293145 -0.542013 1.427130
C 5.645897 0.886141 -1.110149
C 4.759260 -1.091472 0.094947
C 3.844515 -0.467781 -2.102737
C 2.376577 -0.866077 -1.909119
C 0.263046 -0.223456 -0.696647
C -0.263969 0.573345 0.387489
C -1.639208 0.447999 0.735163
C -0.560451 -1.103062 -1.373679
C -2.466928 -0.486168 -0.006824
C -1.927740 -1.237775 -1.029751
C -5.995029 -1.187757 0.469290
C -4.682324 -1.434618 -0.270159
C 0.519829 1.495334 1.151035
C -7.121488 -2.057562 -0.098901
C -0.055147 2.219507 2.164197
C -1.448267 2.033151 2.439152
C -8.436761 -1.814721 0.636954
H 7.369771 -0.261426 0.831815
H 6.858462 0.780435 2.165137
H 7.089440 2.073685 -0.001563
H 5.442980 2.147864 0.649780
H 4.497958 0.040069 1.933858
H 5.538887 -1.383075 2.101629
H 5.339291 1.718429 -1.780338
H 6.444544 0.319384 -1.635464
H 5.493067 -1.801116 -0.344508
H 3.823283 -1.665642 0.274215
H 3.877491 0.323767 -2.886739
H 4.380692 -1.345725 -2.531906
H 2.156434 0.673146 -0.519744
H -0.167716 -1.720904 -2.192482
H -2.525189 -1.946549 -1.596684
H -5.853307 -1.383168 1.552281
H -6.258275 -0.111543 0.408600
H -4.308841 -2.465090 -0.152095
H -4.728931 -1.154613 -1.335376
H 1.581194 1.613585 0.919906
H -7.254676 -1.847764 -1.178846
H -6.846644 -3.128688 -0.026848
H 0.516984 2.926199 2.759925
H -1.930405 2.603178 3.242978
H -9.240315 -2.438171 0.228840
H -8.758513 -0.769656 0.555925
H -8.351353 -2.046768 1.705179


%chk=000209286-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000209286

0 1
O 1.890175 -1.824956 -2.971071
O -3.684186 -0.451149 0.528667
N 4.377256 -0.035508 -0.918640
N 1.749163 -0.329621 -1.135867
N -1.915935 1.113850 1.862615
C 6.155026 0.632922 1.333915
C 5.808587 1.658186 0.228864
C 5.024771 -0.412477 1.468888
C 5.481740 0.948606 -1.100731
C 4.719889 -1.066304 0.107293
C 3.909852 -0.653504 -2.185459
C 2.405286 -1.016507 -2.140039
C 0.384141 -0.374052 -0.759455
C -0.047956 0.421096 0.368975
C -1.438905 0.380417 0.789729
C -0.551943 -1.167008 -1.437877
C -2.371456 -0.458785 0.064601
C -1.913064 -1.208352 -1.029393
C -6.006290 -1.114508 0.529573
C -4.662815 -1.301087 -0.177828
C 0.826363 1.270908 1.125084
C -7.126956 -1.959073 -0.120413
C 0.333423 2.006221 2.204880
C -1.051365 1.893878 2.537621
C -8.485249 -1.777730 0.590575
H 7.101743 0.116934 1.071554
H 6.325391 1.147378 2.298034
H 6.648682 2.360736 0.069952
H 4.929894 2.257483 0.540019
H 4.105990 0.076896 1.849147
H 5.302405 -1.198252 2.196579
H 5.165513 1.686173 -1.861452
H 6.403287 0.443262 -1.484014
H 5.604631 -1.663879 -0.225921
H 3.866415 -1.763653 0.195273
H 4.049390 0.065415 -3.015287
H 4.464841 -1.576884 -2.459562
H 2.431200 0.245430 -0.605568
H -0.216188 -1.761444 -2.290505
H -2.598588 -1.846008 -1.593851
H -5.891383 -1.391997 1.594658
H -6.277303 -0.041872 0.506168
H -4.333630 -2.361214 -0.136444
H -4.724788 -0.990852 -1.242579
H 1.887405 1.359631 0.865216
H -7.229694 -1.679909 -1.189121
H -6.841686 -3.031011 -0.102567
H 0.986678 2.660756 2.790485
H -1.467167 2.459390 3.380473
H -9.274502 -2.387398 0.114010
H -8.809003 -0.720497 0.561564
H -8.418887 -2.078770 1.652830


