%chk=000233630.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000233630

0 1
O 3.340537 0.397847 0.638533
O 3.765667 -1.612875 -0.305267
O -3.426915 0.784087 0.420303
N 6.886777 1.058881 -0.242503
N -2.701027 -1.244137 -0.459131
N -5.010471 -0.738774 -0.344343
C 5.410291 1.047727 -0.481915
C 7.585451 -0.035056 -0.996650
C 7.480425 2.404807 -0.540602
C 4.771776 0.617686 0.846556
C 7.167322 -1.407530 -0.471989
C 8.839461 2.540325 0.148301
C 2.951957 -0.786012 0.050707
C 1.482334 -0.857037 -0.060062
C -1.295107 -1.065226 -0.302834
C 0.911504 -2.010880 -0.626576
C 0.654286 0.187587 0.383437
C -0.468471 -2.123134 -0.751428
C -0.729022 0.090558 0.264768
C -3.694069 -0.290903 -0.077389
C -6.201896 0.012702 -0.065806
C -7.427505 -0.601048 -0.401214
C -6.177598 1.293134 0.509204
C -8.619558 0.080698 -0.154492
C -7.384059 1.954689 0.746180
C -8.604712 1.356793 0.418028
H 5.107769 0.336181 -1.283459
H 5.013175 2.035562 -0.791741
H 7.407948 0.023434 -2.092751
H 8.680420 0.097546 -0.841491
H 7.583275 2.598760 -1.630159
H 6.793780 3.183812 -0.139187
H 4.764227 1.417497 1.605635
H 5.225625 -0.302704 1.254441
H 7.353453 -1.494249 0.605546
H 6.093442 -1.605491 -0.623710
H 7.721316 -2.205739 -0.974950
H 8.769444 2.259681 1.208527
H 9.596378 1.889158 -0.303274
H 9.205784 3.570275 0.095490
H 1.565897 -2.819904 -0.967958
H 1.106552 1.082109 0.825173
H -0.896211 -3.020489 -1.190906
H -1.367050 0.911634 0.613253
H -2.990535 -2.129788 -0.878895
H -5.159382 -1.658062 -0.762377
H -7.456300 -1.591515 -0.846312
H -5.228825 1.773053 0.771340
H -9.569344 -0.388412 -0.411440
H -7.368231 2.949593 1.192921
H -9.538386 1.881249 0.607069


%chk=000233630-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000233630

0 1
O 3.431474 0.300784 0.702279
O 3.676608 -1.811927 -0.265671
O -3.528430 1.024331 0.476413
N 7.005882 1.017571 -0.362931
N -2.789466 -1.078058 -0.306333
N -5.073940 -0.617379 -0.219740
C 5.534397 0.907089 -0.510244
C 7.762589 0.025647 -1.168974
C 7.529791 2.405033 -0.452802
C 4.919312 0.397230 0.809034
C 7.522791 -1.428371 -0.718610
C 8.870790 2.598453 0.282573
C 2.932707 -0.872542 0.125740
C 1.449363 -0.870652 0.042259
C -1.384508 -0.953273 -0.168104
C 0.804323 -2.014816 -0.496831
C 0.658049 0.225722 0.472412
C -0.593131 -2.057468 -0.599802
C -0.744700 0.197497 0.371910
C -3.780884 -0.127339 0.021860
C -6.313606 0.064503 -0.045728
C -7.495933 -0.662998 -0.353970
C -6.413527 1.406966 0.407574
C -8.761327 -0.059283 -0.213858
C -7.689509 1.996050 0.541165
C -8.867713 1.277736 0.235138
H 5.265352 0.205651 -1.324852
H 5.083832 1.886815 -0.765009
H 7.516730 0.121605 -2.258240
H 8.838289 0.255952 -1.064895
H 7.637208 2.738671 -1.517091
H 6.779874 3.072283 0.011999
H 5.090230 1.109996 1.630581
H 5.331222 -0.592360 1.065618
H 7.826144 -1.557234 0.335777
H 6.461619 -1.723218 -0.810473
H 8.118807 -2.121276 -1.341607
H 8.770372 2.294788 1.339318
H 9.683519 2.001559 -0.168777
H 9.177910 3.660347 0.244623
H 1.420077 -2.857142 -0.828087
H 1.155243 1.106185 0.888638
H -1.079809 -2.948637 -1.017607
H -1.351576 1.043254 0.697030
H -3.097556 -1.966829 -0.707381
H -5.165966 -1.579534 -0.552989
H -7.425262 -1.701806 -0.704104
H -5.505369 1.961463 0.647904
H -9.662353 -0.633664 -0.455802
H -7.758060 3.032238 0.891030
H -9.850277 1.748484 0.344237


