%chk=000200320.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000200320

0 1
O 3.511264 -0.708199 -0.128230
O 3.891460 -1.213838 2.069905
N -3.644016 -1.102823 0.927726
C -2.084254 0.372889 -0.342970
C -2.737384 -0.657533 -1.317465
C -2.892952 0.191227 0.983222
C -2.268199 1.814087 -0.876802
C -3.878998 -1.336989 -0.535142
C -0.597162 0.071301 -0.208103
C -1.635119 2.879329 0.028647
C -2.876647 -2.221223 1.551226
C 0.205840 0.077844 -1.368373
C 0.007617 -0.203290 1.024047
C -1.861533 4.286900 -0.518470
C 1.568995 -0.190356 -1.302359
C 1.376293 -0.477098 1.123614
C 2.133871 -0.466703 -0.045255
C 4.309710 -1.071282 0.952018
C 5.694872 -1.228436 0.429789
H -2.002600 -1.409941 -1.651256
H -3.114894 -0.174553 -2.231257
H -2.260415 0.264110 1.887619
H -3.660856 0.990210 1.078919
H -3.349502 2.021785 -0.998878
H -1.835977 1.894112 -1.892740
H -4.858340 -0.871761 -0.778070
H -3.966690 -2.411405 -0.774673
H -0.547568 2.687398 0.130440
H -2.049635 2.806524 1.052675
H -2.741331 -2.007139 2.622951
H -1.888655 -2.409722 1.105064
H -3.472731 -3.144692 1.481083
H -0.245037 0.298486 -2.336475
H -0.593759 -0.204680 1.938619
H -1.423742 4.408811 -1.515613
H -2.928328 4.524848 -0.596730
H -1.404898 5.040978 0.132797
H 2.196344 -0.188200 -2.190619
H 1.829683 -0.693085 2.093978
H 5.766842 -1.025757 -0.651922
H 6.062251 -2.252811 0.603851
H 6.385282 -0.541721 0.945912


%chk=000200320-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000200320

0 1
O 3.656750 -0.823112 -0.162275
O 4.293596 -0.433023 2.073215
N -3.818287 -1.088569 0.839744
C -2.051890 0.284894 -0.289671
C -2.786653 -0.667518 -1.309649
C -2.897313 0.063740 1.045149
C -2.212208 1.769911 -0.777506
C -4.136323 -1.007243 -0.613758
C -0.551009 -0.039381 -0.172703
C -1.658649 2.859391 0.168597
C -3.237739 -2.393887 1.243995
C 0.183119 -0.419249 -1.331811
C 0.181385 0.104120 1.033221
C -1.918641 4.282622 -0.371802
C 1.567210 -0.667714 -1.281715
C 1.572153 -0.140376 1.114572
C 2.257168 -0.531828 -0.057320
C 4.578770 -0.757060 0.900981
C 5.956888 -1.138422 0.403374
H -2.206694 -1.595699 -1.459910
H -2.928494 -0.190752 -2.296517
H -2.281134 -0.110021 1.941357
H -3.512346 0.965951 1.227159
H -3.294520 1.954852 -0.946383
H -1.715437 1.873238 -1.764161
H -4.867527 -0.189474 -0.768495
H -4.592763 -1.946090 -0.970679
H -0.571299 2.709775 0.308508
H -2.120986 2.760572 1.171450
H -3.049364 -2.384265 2.331946
H -2.280862 -2.658569 0.733358
H -3.972110 -3.192764 1.037584
H -0.333864 -0.523498 -2.291797
H -0.328042 0.419688 1.949493
H -1.449777 4.421910 -1.364456
H -3.002456 4.476284 -0.483277
H -1.505996 5.051952 0.306333
H 2.125537 -0.964795 -2.174752
H 2.104641 -0.026185 2.058888
H 5.947782 -1.374995 -0.669570
H 6.320355 -2.010354 0.974792
H 6.656133 -0.306455 0.597191


