%chk=000288802.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000288802

0 1
O 0.077929 -0.277408 2.110187
O 4.164592 -1.875410 -2.174109
O -1.410433 1.449140 0.573315
N 2.237950 -0.717145 -0.386798
C 1.226162 0.306072 0.073020
C 0.033107 -0.491693 0.688768
C -1.358967 0.054830 0.212927
C 3.632338 -0.171075 -0.487162
C 1.838552 -1.260357 -1.732507
C 1.802505 1.308819 1.056071
C -2.520335 -0.654878 0.904573
C -1.527231 -0.000916 -1.296495
C 4.577454 -1.305216 -0.915135
C 2.815554 -2.380057 -2.121617
C 1.779816 2.672080 0.725117
C 2.347821 0.905013 2.285474
C -2.491383 -2.029792 1.176260
C -1.531397 1.185360 -2.044029
C -3.650423 0.096872 1.256586
C -1.682099 -1.232902 -1.948558
C 2.304693 3.618266 1.610351
C 2.869917 1.853917 3.167439
C -3.581013 -2.642756 1.801970
C -1.673064 1.138360 -3.433283
C -4.737367 -0.518554 1.882107
C -1.821324 -1.275237 -3.338533
C 2.852106 3.211542 2.830602
C -4.704196 -1.889427 2.157206
C -1.813762 -0.091559 -4.083440
H 0.824487 0.886042 -0.808310
H 0.130737 -1.580759 0.485936
H 3.709642 0.679374 -1.197919
H 3.951165 0.205534 0.509144
H 0.808642 -1.669479 -1.669648
H 1.829001 -0.480134 -2.525364
H 4.621456 -2.107584 -0.157529
H 5.592115 -0.935255 -1.143851
H 2.652664 -2.734958 -3.154119
H 2.775636 -3.225045 -1.411931
H -0.551470 -0.879988 2.566966
H -0.959088 1.575864 1.453298
H 1.346235 3.001000 -0.218162
H 2.340284 -0.155212 2.549292
H -1.628828 -2.633547 0.898393
H -1.434511 2.145294 -1.528112
H -3.668154 1.167982 1.035353
H -1.712640 -2.159748 -1.377932
H 2.284000 4.674253 1.347880
H 3.286665 1.535453 4.121029
H -3.554613 -3.711055 2.010841
H -1.677680 2.062848 -4.008768
H -5.612099 0.071100 2.153041
H -1.943287 -2.233195 -3.841414
H 3.259737 3.949242 3.518511
H -5.551395 -2.369081 2.644086
H -1.923302 -0.127536 -5.165818


%chk=000288802-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000288802

0 1
O 0.069056 -0.431496 2.159890
O 4.207763 -2.057032 -2.133016
O -1.395220 1.492564 0.717638
N 2.294832 -0.754523 -0.322574
C 1.248262 0.253664 0.094750
C 0.010517 -0.505357 0.687812
C -1.375245 0.097968 0.246362
C 3.612217 -0.135560 -0.662606
C 1.856376 -1.544945 -1.512606
C 1.819278 1.307568 1.046611
C -2.547271 -0.674169 0.907158
C -1.549174 0.125196 -1.281081
C 4.635943 -1.232988 -0.989982
C 2.888934 -2.635039 -1.839797
C 1.680155 2.681618 0.735546
C 2.512626 0.942984 2.229920
C -2.494901 -2.062756 1.201271
C -1.481218 1.348710 -1.991564
C -3.740242 0.034816 1.199359
C -1.764713 -1.076366 -2.002597
C 2.217039 3.676368 1.585166
C 3.053626 1.931871 3.077809
C -3.604400 -2.722167 1.780691
C -1.611310 1.367952 -3.398362
C -4.850114 -0.623313 1.769612
C -1.883287 -1.058424 -3.409538
C 2.907555 3.304069 2.760433
C -4.787062 -2.005656 2.065850
C -1.804184 0.164778 -4.114887
H 0.887558 0.799419 -0.809739
H 0.072318 -1.563233 0.375933
H 3.521265 0.555074 -1.537987
H 3.979226 0.451296 0.194457
H 0.883590 -2.030803 -1.321823
H 1.721690 -0.882889 -2.404320
H 4.781208 -1.879471 -0.097308
H 5.601158 -0.792809 -1.290732
H 2.600107 -3.189893 -2.748290
H 2.969312 -3.338149 -0.981807
H -0.641793 -1.023412 2.524454
H -0.967277 1.485178 1.617595
H 1.141867 2.974232 -0.173782
H 2.612730 -0.117953 2.476525
H -1.597698 -2.652410 0.973528
H -1.342331 2.273995 -1.425852
H -3.774727 1.106140 0.979442
H -1.867409 -2.028393 -1.469376
H 2.098382 4.735225 1.328733
H 3.586095 1.635306 3.988816
H -3.542336 -3.793051 2.004847
H -1.562464 2.322516 -3.934675
H -5.764602 -0.059128 1.985009
H -2.047227 -1.995797 -3.953042
H 3.327119 4.071712 3.420811
H -5.647611 -2.515567 2.512744
H -1.901088 0.179833 -5.206229


