%chk=000289678.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000289678

0 1
O 7.162478 0.421304 0.442905
O 6.424545 -1.397313 1.351043
N -4.548429 -2.038209 -0.133700
N 1.017072 1.060394 -0.867151
N -0.041470 0.247978 -0.582616
N 6.263685 -0.352216 0.739530
C -3.576684 0.229235 -0.066346
C -2.364660 -0.301794 -0.631455
C -4.649446 -0.680931 0.161750
C -3.758928 1.601104 0.288733
C -2.278705 -1.647987 -0.908846
C -5.883815 -0.207668 0.717644
C -1.243199 0.613334 -0.938473
C -4.948263 2.031261 0.822927
C 2.307715 0.666534 -0.442367
C -6.023129 1.118180 1.036584
C -3.406541 -2.489442 -0.640086
C 3.382924 1.531680 -0.766034
C 2.539601 -0.531643 0.272177
C 4.898924 0.000094 0.332040
C 4.671864 1.193436 -0.377321
C 3.830495 -0.860025 0.655844
H -2.937352 2.299681 0.139228
H -1.372210 -2.086935 -1.323370
H -6.687418 -0.930144 0.875059
H -1.528023 1.539415 -1.457983
H -5.090847 3.076333 1.096157
H -6.953928 1.495448 1.460674
H -3.345455 -3.564185 -0.858765
H 3.212338 2.455278 -1.314956
H 1.703060 -1.190466 0.520316
H 0.908390 1.950500 -1.364303
H 5.519552 1.847226 -0.617098
H 4.033660 -1.784259 1.211158


%chk=000289678-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000289678

0 1
O 7.417266 0.391209 -0.236871
O 6.772501 -1.797846 -0.120314
N -4.571289 -2.045471 0.165644
N 1.074019 1.109403 -0.111275
N 0.038513 0.215425 -0.046338
N 6.509415 -0.530872 -0.171531
C -3.706607 0.300452 0.040126
C -2.346846 -0.208180 0.030870
C -4.784614 -0.673179 0.109035
C -4.055873 1.690469 -0.013696
C -2.164211 -1.604735 0.089453
C -6.145210 -0.225466 0.121040
C -1.194091 0.694337 -0.037182
C -5.392455 2.098235 -0.000298
C 2.406747 0.677882 -0.124699
C -6.447801 1.135326 0.067571
C -3.289626 -2.470596 0.154838
C 3.439549 1.657576 -0.193572
C 2.738539 -0.706334 -0.071297
C 5.099307 -0.114482 -0.155503
C 4.784724 1.264076 -0.209168
C 4.083961 -1.098917 -0.086710
H -3.276363 2.457804 -0.066426
H -1.151627 -2.016324 0.083976
H -6.922066 -0.994101 0.173728
H -1.379463 1.782772 -0.080267
H -5.636477 3.165477 -0.042222
H -7.490156 1.471202 0.077211
H -3.142958 -3.556073 0.200576
H 3.184231 2.723348 -0.234861
H 1.934198 -1.442559 -0.018993
H 0.888536 2.123328 -0.151857
H 5.595084 1.995539 -0.261656
H 4.368944 -2.153529 -0.046429


