%chk=000231147.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231147

0 1
O 7.644970 -1.375617 -0.246319
N -1.110277 0.932119 0.147183
N 1.789456 0.719320 0.026259
C -0.227227 2.109097 0.487875
C 1.085198 1.992334 -0.334022
C -0.394607 -0.347455 0.477128
C 0.912205 -0.442866 -0.330365
C 3.118815 0.632486 -0.664363
C -2.416444 0.985879 0.887648
C -0.918738 3.428580 0.120507
C 4.007249 -0.368024 0.096229
C -3.361831 -0.080047 0.384703
C 5.414185 -0.421580 -0.504405
C 6.303556 -1.402497 0.264353
C -3.557579 -0.263284 -0.993130
C -4.075872 -0.869221 1.298042
C -4.459960 -1.225709 -1.450111
C -4.981052 -1.829108 0.834860
C -5.175248 -2.009323 -0.537564
H 0.034723 2.118796 1.578626
H 0.854249 2.068192 -1.418408
H 1.748657 2.843957 -0.073956
H -1.058774 -1.195357 0.198089
H -0.171919 -0.445598 1.562277
H 1.443089 -1.380928 -0.061578
H 0.680248 -0.493709 -1.416759
H 3.037603 0.344551 -1.733812
H 3.598548 1.635782 -0.643240
H -2.887094 1.980038 0.693649
H -2.287103 0.913294 1.990426
H -0.232640 4.276745 0.214572
H -1.288677 3.409545 -0.913251
H -1.778530 3.633402 0.768063
H 3.544508 -1.373857 0.084839
H 4.051529 -0.074106 1.165409
H 5.883297 0.583370 -0.485678
H 5.367537 -0.706516 -1.572411
H 6.444316 -1.103725 1.320854
H 5.923398 -2.437899 0.220558
H -2.988995 0.344509 -1.698698
H -3.930238 -0.738950 2.367925
H -4.607838 -1.365915 -2.519332
H -5.535022 -2.437862 1.547011
H -5.879722 -2.756385 -0.895622
H 7.660950 -1.629553 -1.188062


%chk=000231147-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000231147

0 1
O 7.764999 -1.378770 -0.521103
N -1.103614 0.920101 0.280549
N 1.801269 0.738685 0.140989
C -0.260814 2.132844 0.515069
C 1.070374 1.966549 -0.253480
C -0.372356 -0.308298 0.687291
C 0.944294 -0.450042 -0.085465
C 3.121047 0.649134 -0.530693
C -2.446505 0.971436 0.910741
C -0.955171 3.428092 0.046639
C 4.057501 -0.408784 0.088478
C -3.393429 -0.101223 0.375459
C 5.467074 -0.372530 -0.546447
C 6.407941 -1.434891 0.048995
C -3.405351 -0.427922 -1.004610
C -4.312634 -0.746543 1.238175
C -4.322479 -1.374797 -1.510646
C -5.235210 -1.692843 0.734002
C -5.243926 -2.009616 -0.643604
H -0.007380 2.221909 1.603389
H 0.837159 1.975641 -1.350677
H 1.714437 2.838692 -0.033554
H -1.014689 -1.182311 0.479098
H -0.147235 -0.297695 1.783600
H 1.470600 -1.354143 0.268343
H 0.715317 -0.585352 -1.174393
H 3.010024 0.446120 -1.629713
H 3.606672 1.640997 -0.438578
H -2.888694 1.960290 0.692254
H -2.389029 0.886000 2.026549
H -0.223527 4.256145 0.017220
H -1.368735 3.294231 -0.969677
H -1.771506 3.743482 0.719093
H 3.630200 -1.423920 -0.036511
H 4.125300 -0.221186 1.177636
H 5.925063 0.625610 -0.401584
H 5.382507 -0.530493 -1.643687
H 6.560622 -1.257791 1.127224
H 5.969308 -2.449385 -0.077658
H -2.677219 0.062034 -1.660702
H -4.305775 -0.509931 2.309937
H -4.321030 -1.618801 -2.579514
H -5.939915 -2.184701 1.414409
H -5.955830 -2.744551 -1.036349
H 7.703246 -1.514566 -1.500492


