%chk=000266309.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000266309

0 1
O -1.743111 -2.425944 1.882314
O -1.454201 0.857448 -1.355533
N -1.683568 -0.819350 0.203721
N -3.016138 -0.478635 0.588603
C 1.171140 -1.279085 0.030778
C 3.856582 0.064278 0.294380
C 1.497292 -0.288854 1.172315
C 2.479911 -1.927518 -0.480573
C 2.555823 0.743213 0.767132
C 3.534236 -0.886536 -0.876019
C 4.970102 1.100868 -0.070976
C 0.234762 -2.391889 0.552110
C 0.437648 -0.575200 -1.128258
C -1.134847 -1.911590 0.977058
C -0.951832 -0.096832 -0.794019
C 6.258812 0.350531 -0.468708
C 4.537736 2.012201 -1.233167
C 5.284856 1.970914 1.163982
C -3.070115 0.921918 1.138698
C -4.004056 -0.790994 -0.495878
C -4.507288 1.323086 1.499937
C -4.454711 0.365512 -1.397090
C -5.216684 2.066457 0.361397
C -5.626524 1.154404 -0.801769
H 4.249638 -0.552526 1.140468
H 1.852465 -0.853867 2.056590
H 0.580033 0.233116 1.504759
H 2.272024 -2.590416 -1.340524
H 2.894156 -2.583579 0.310559
H 2.158678 1.400983 -0.030560
H 2.764642 1.407888 1.627888
H 4.454171 -1.407169 -1.206068
H 3.186945 -0.305304 -1.751438
H 0.697182 -2.917992 1.415640
H 0.101349 -3.179625 -0.219349
H 0.373475 -1.242774 -2.013438
H 1.033967 0.299336 -1.477377
H 6.596559 -0.320460 0.326966
H 7.076132 1.050316 -0.672416
H 6.117616 -0.250585 -1.372533
H 3.633745 2.578961 -0.987157
H 4.330837 1.438604 -2.141997
H 5.318990 2.739246 -1.478828
H 4.421669 2.571573 1.469031
H 6.104407 2.667485 0.958644
H 5.583683 1.361062 2.022003
H -2.627393 1.673882 0.445855
H -2.443880 0.911989 2.059783
H -4.878449 -1.210769 0.059400
H -3.616282 -1.624661 -1.119831
H -4.475542 1.972842 2.396936
H -5.091988 0.431812 1.804369
H -4.748792 -0.037101 -2.384924
H -3.596448 1.044451 -1.601496
H -4.563870 2.878024 -0.017506
H -6.119057 2.569375 0.761462
H -6.417637 0.455463 -0.466591
H -6.089549 1.772316 -1.596649


%chk=000266309-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000266309

0 1
O -1.868946 -2.406187 1.721904
O -1.511711 0.759319 -1.713492
N -1.695033 -0.782123 0.032566
N -2.991257 -0.314614 0.355884
C 1.171190 -1.262651 -0.066393
C 3.894946 0.099632 0.292248
C 1.466473 -0.235195 1.065825
C 2.513868 -1.914397 -0.500773
C 2.566885 0.791481 0.702669
C 3.609108 -0.886253 -0.872347
C 5.084049 1.097833 0.007228
C 0.214725 -2.366551 0.448420
C 0.466781 -0.600642 -1.277868
C -1.183105 -1.877077 0.816589
C -0.966868 -0.142477 -1.022134
C 6.392015 0.292717 -0.240344
C 4.811214 2.000717 -1.227104
C 5.317864 2.004754 1.248441
C -2.997771 1.003716 1.025494
C -4.091178 -0.801931 -0.513054
C -4.391890 1.414716 1.549745
C -4.836980 0.264808 -1.355096
C -5.322691 2.045048 0.484950
C -5.897710 1.056719 -0.556032
H 4.221009 -0.514771 1.164546
H 1.791897 -0.801720 1.963205
H 0.539897 0.299728 1.354550
H 2.336237 -2.601408 -1.353788
H 2.883655 -2.539940 0.339084
H 2.215203 1.447134 -0.119329
H 2.727502 1.448098 1.577352
H 4.527432 -1.437074 -1.146368
H 3.300859 -0.320954 -1.774377
H 0.619320 -2.864332 1.347372
H 0.100805 -3.153165 -0.327745
H 0.430194 -1.323388 -2.120199
H 1.009330 0.282230 -1.655218
H 6.602810 -0.393728 0.602476
H 7.252476 0.980973 -0.339029
H 6.343522 -0.307684 -1.166599
H 3.896664 2.608240 -1.097679
H 4.701330 1.407785 -2.153510
H 5.654878 2.699911 -1.380375
H 4.482900 2.709259 1.411620
H 6.236067 2.606979 1.114066
H 5.441550 1.400372 2.167920
H -2.617882 1.810808 0.357304
H -2.303220 0.926047 1.885451
H -4.833442 -1.345032 0.110662
H -3.640196 -1.551582 -1.188298
H -4.224294 2.165090 2.347413
H -4.877138 0.544707 2.034289
H -5.353159 -0.271306 -2.177482
H -4.099269 0.942575 -1.824343
H -4.761229 2.843837 -0.042932
H -6.168550 2.543556 1.000055
H -6.566070 0.333275 -0.042482
H -6.535766 1.624418 -1.262828


