%chk=000214784.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000214784

1 1
O -1.383110 -0.178387 -1.648952
O 1.066285 0.274116 -2.175967
O -0.920725 -1.723939 -0.084865
N -4.304129 -0.245950 0.148413
N -0.066692 2.292279 2.074227
C 0.846329 -0.030054 -0.798311
C -3.707570 0.228775 -1.178887
C 1.964170 -0.973733 -0.411803
C 0.637609 1.231587 0.008206
C 2.426151 -1.195562 0.896603
C 1.951203 -0.497574 2.143035
C 0.477338 -0.081189 2.177977
C 0.318469 1.183231 1.384859
C -2.705482 -0.725400 -1.838047
C -4.969457 -1.592918 -0.025131
C -3.244670 -0.343761 1.218614
C -5.346395 0.765477 0.584301
C -0.520463 -0.803190 -0.748162
C 2.552512 -1.684883 -1.482315
C 0.735119 2.490835 -0.601946
C 3.469752 -2.125845 1.096758
C 3.583418 -2.592132 -1.268958
C 4.045080 -2.815415 0.034427
C 0.411002 3.639114 0.121571
C -0.023327 3.497222 1.449461
H -4.542565 0.435707 -1.891887
H -3.193454 1.213539 -1.017180
H 2.143280 -1.145393 3.029555
H 2.601020 0.395805 2.307309
H 0.170013 0.084191 3.237075
H -0.165760 -0.904552 1.808325
H -2.748070 -1.769782 -1.469095
H -2.818902 -0.719553 -2.944507
H -4.236220 -2.378296 -0.302916
H -5.453784 -1.934028 0.910750
H -5.748523 -1.571882 -0.809121
H -3.678867 -0.546918 2.214977
H -2.524260 -1.171773 1.012475
H -2.648925 0.585605 1.305065
H -5.822675 0.474940 1.541407
H -4.903130 1.767791 0.742085
H -6.158451 0.872574 -0.158732
H 2.198938 -1.507543 -2.504403
H 1.078406 2.572241 -1.638696
H 3.839390 -2.307751 2.107364
H 0.326428 0.807598 -2.560089
H 4.030806 -3.124513 -2.108145
H 4.852915 -3.526919 0.214478
H 0.504521 4.627287 -0.328335
H -0.329449 4.363722 2.051637


%chk=000214784-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000214784

1 1
O -1.447860 -0.012086 -1.702755
O 1.124167 0.411059 -2.191039
O -0.925651 -1.787039 -0.288261
N -4.218679 -0.126335 0.118474
N -0.133006 2.170250 2.210125
C 0.836891 -0.030730 -0.819282
C -3.941524 0.089343 -1.393656
C 1.948181 -1.035225 -0.433390
C 0.638596 1.204347 0.098756
C 2.347630 -1.352766 0.900397
C 1.821495 -0.732148 2.197220
C 0.357906 -0.227738 2.218125
C 0.245286 1.082009 1.464616
C -2.749611 -0.639206 -2.023760
C -4.176579 -1.610844 0.488406
C -3.214791 0.643458 0.982616
C -5.620293 0.421892 0.402328
C -0.554060 -0.751269 -0.871507
C 2.569372 -1.703373 -1.523824
C 0.772236 2.504466 -0.443500
C 3.369676 -2.326861 1.071534
C 3.581900 -2.660390 -1.326518
C 3.989074 -2.975999 -0.012523
C 0.452061 3.629317 0.346784
C -0.045068 3.412146 1.650630
H -4.853440 -0.251219 -1.917107
H -3.843290 1.178991 -1.537780
H 1.928772 -1.489007 2.995562
H 2.482020 0.109672 2.489353
H 0.056781 -0.021765 3.259012
H -0.298500 -1.024659 1.822699
H -2.712881 -1.713289 -1.774995
H -2.857782 -0.532360 -3.116863
H -3.145375 -1.982439 0.388918
H -4.511802 -1.716256 1.531691
H -4.855475 -2.167677 -0.176401
H -3.499834 0.529271 2.039619
H -2.209332 0.237355 0.832912
H -3.234314 1.706995 0.701857
H -5.817106 0.355400 1.482926
H -5.668498 1.473872 0.081037
H -6.363297 -0.174616 -0.148901
H 2.265923 -1.438647 -2.538770
H 1.151798 2.628834 -1.461431
H 3.683266 -2.575944 2.092540
H 0.305438 0.831654 -2.565413
H 4.046947 -3.149770 -2.188281
H 4.773882 -3.718338 0.166642
H 0.577003 4.645286 -0.038993
H -0.363160 4.247180 2.284679


