%chk=000258837.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258837

0 1
O 4.781958 -0.458165 0.651549
O 3.636950 -1.442466 -1.027744
N 1.923851 0.871593 -0.171314
C 3.342846 0.962064 -0.651238
C 4.047906 2.100655 0.116838
C 1.743465 1.899762 0.904354
C 2.929626 2.878457 0.828414
C 0.939546 0.979035 -1.293853
C -0.435924 0.586189 -0.798738
C 3.894091 -0.443216 -0.396964
C -0.725461 -0.800043 -0.462159
C -1.402926 1.540310 -0.697681
C -2.033029 -1.149645 -0.041006
C -2.740881 1.214018 -0.263622
C -3.063129 -0.123213 0.063256
C 0.266579 -1.814468 -0.544888
C -2.316030 -2.505859 0.274918
C -3.735418 2.224564 -0.164612
C -4.386954 -0.420552 0.485357
C -0.033010 -3.125835 -0.231654
C -1.338124 -3.476026 0.180330
C -5.014214 1.908560 0.248842
C -5.342428 0.572449 0.576815
C 5.330339 -1.751803 1.024552
H 3.422360 1.136696 -1.755476
H 4.625994 2.743437 -0.565660
H 4.771643 1.699181 0.854476
H 1.749820 1.340244 1.867104
H 0.766572 2.413697 0.838188
H 3.243029 3.212357 1.831318
H 2.659238 3.788934 0.266815
H 1.250378 0.271559 -2.101400
H 0.918012 1.990583 -1.756608
H -1.199668 2.580842 -0.947122
H 1.287703 -1.553289 -0.846838
H -3.322751 -2.775497 0.596184
H -3.475285 3.250120 -0.419842
H -4.642594 -1.450853 0.738872
H 0.734029 -3.895780 -0.298699
H -1.562128 -4.513370 0.422527
H -5.778858 2.679355 0.325936
H -6.354420 0.337261 0.901014
H 4.556508 -2.317742 1.552585
H 6.161406 -1.481270 1.682910
H 5.667784 -2.293430 0.134563


%chk=000258837-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000258837

0 1
O 4.655771 -0.696579 0.409722
O 3.739373 -0.965480 -1.709893
N 1.989500 1.066989 -0.104953
C 3.416281 1.181571 -0.546434
C 4.101920 2.071184 0.517591
C 1.732286 2.056190 0.987263
C 2.955487 3.007817 0.973319
C 1.002394 0.992255 -1.210215
C -0.388277 0.568920 -0.753947
C 3.956143 -0.242641 -0.705326
C -0.653511 -0.782931 -0.270578
C -1.427754 1.481946 -0.816937
C -1.987093 -1.148658 0.150483
C -2.772780 1.160988 -0.403527
C -3.068289 -0.159285 0.091529
C 0.384911 -1.765840 -0.224316
C -2.212134 -2.484756 0.605692
C -3.810026 2.141342 -0.479253
C -4.410097 -0.437564 0.496730
C 0.130792 -3.068502 0.220423
C -1.178954 -3.429810 0.642639
C -5.116046 1.840023 -0.076151
C -5.414675 0.537523 0.416692
C 5.074379 -2.119543 0.368580
H 3.482748 1.655413 -1.552841
H 4.969507 2.611089 0.102425
H 4.451786 1.449623 1.358107
H 1.650309 1.538734 1.962712
H 0.777270 2.584713 0.811593
H 3.149852 3.467284 1.957837
H 2.804793 3.821551 0.238714
H 1.398602 0.268643 -1.948033
H 0.912779 1.973594 -1.740170
H -1.235034 2.495250 -1.193418
H 1.393379 -1.485102 -0.535851
H -3.212053 -2.789061 0.929087
H -3.565228 3.139968 -0.860875
H -4.672451 -1.428342 0.879722
H 0.937053 -3.810240 0.241001
H -1.381310 -4.448014 0.993236
H -5.905119 2.597298 -0.137758
H -6.434979 0.296139 0.734706
H 4.186177 -2.773063 0.334233
H 5.641939 -2.271263 1.297239
H 5.698781 -2.309973 -0.520199


