%chk=000267047.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267047

0 1
I -5.529644 2.731131 1.127773
I -4.638137 -0.282697 0.697769
O 3.361420 1.181742 -0.891425
O 3.964779 -3.253344 0.035805
N 2.075466 1.130173 1.037325
N 2.594344 -1.746497 -1.091862
N 1.023406 1.763486 0.429114
N 1.426858 -2.299960 -0.633714
C 5.429873 -0.459714 0.217902
C 4.279055 0.085717 1.075241
C 4.987834 -1.309900 -0.981412
C 3.248970 0.850595 0.265806
C 3.845432 -2.239534 -0.606215
C -1.198476 2.668030 0.462576
C -0.970427 -2.280304 -0.484558
C -0.063351 1.987737 1.118289
C 0.302542 -1.764177 -1.024837
C -2.487464 2.478641 0.997756
C -1.993736 -1.347436 -0.237267
C -1.025594 3.487026 -0.666072
C -1.182080 -3.640299 -0.209923
C -3.566567 3.096728 0.377241
C -3.203847 -1.789834 0.286537
C -2.128954 4.109852 -1.254911
C -2.413266 -4.061449 0.300617
C -3.415951 3.916423 -0.737288
C -3.434601 -3.135859 0.553749
H 6.093318 -1.064388 0.872893
H 6.044058 0.385173 -0.159851
H 3.801138 -0.761416 1.619413
H 4.698698 0.747511 1.863803
H 5.839696 -1.926818 -1.339717
H 4.729684 -0.638853 -1.830656
H 2.005568 0.801053 2.008809
H 2.582537 -0.904064 -1.695458
H -0.236148 1.703557 2.168150
H 0.196653 -0.910748 -1.715370
H -2.631950 1.840484 1.874119
H -1.830227 -0.288573 -0.449644
H -0.025068 3.628641 -1.084561
H -0.380811 -4.359903 -0.389564
H -1.989991 4.746660 -2.129022
H -2.579502 -5.118073 0.508135
H -4.274097 4.396469 -1.209557
H -4.389939 -3.472289 0.955763


%chk=000267047-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000267047

0 1
I -5.295169 3.118358 2.032671
I -5.228606 -0.668341 -1.062965
O 3.619403 1.421006 -0.883485
O 3.899390 -3.195888 0.222409
N 2.236900 1.101664 0.982997
N 2.564573 -1.677905 -0.985523
N 1.153285 1.743096 0.410717
N 1.363434 -2.225011 -0.577126
C 5.573756 -0.488200 0.171995
C 4.518157 0.203372 1.071467
C 4.988850 -1.349414 -0.989462
C 3.450976 0.970563 0.282568
C 3.797620 -2.192730 -0.530230
C -1.151258 2.471279 0.570251
C -1.056193 -2.107684 -0.553012
C 0.041195 1.806220 1.112937
C 0.264515 -1.597321 -0.945193
C -2.343971 2.475834 1.346223
C -2.211246 -1.352148 -0.901030
C -1.139701 3.110181 -0.702405
C -1.206756 -3.328359 0.164950
C -3.497403 3.112872 0.847062
C -3.487106 -1.822771 -0.531933
C -2.303640 3.737376 -1.182381
C -2.490480 -3.777845 0.523366
C -3.496029 3.746809 -0.413932
C -3.646992 -3.031373 0.179372
H 6.192903 -1.130214 0.824264
H 6.235594 0.274592 -0.275059
H 4.032443 -0.551269 1.721319
H 5.036531 0.915800 1.744188
H 5.772134 -2.040319 -1.346595
H 4.709244 -0.683780 -1.824295
H 2.158680 0.671159 1.917957
H 2.579822 -0.819024 -1.560067
H -0.048916 1.364902 2.126626
H 0.284566 -0.666968 -1.547984
H -2.361157 1.981587 2.323454
H -2.101351 -0.409910 -1.448788
H -0.212605 3.107756 -1.283764
H -0.309316 -3.899183 0.422283
H -2.297979 4.231218 -2.159966
H -2.609319 -4.717903 1.072874
H -4.395738 4.237709 -0.794990
H -4.641537 -3.389095 0.459935


