%chk=000200202.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000200202

0 1
O 1.142576 1.737915 1.040764
N 0.810012 -0.435414 0.487038
N 3.778547 0.094992 -0.260681
C -1.657054 -0.402901 0.650064
C -0.354612 -0.529551 1.406574
C -3.744988 2.472285 -0.786784
C -3.282598 1.079931 -0.401045
C -2.081025 0.883449 0.290693
C 2.596477 0.910457 -0.679116
C -2.437958 -1.522220 0.302768
C 1.471051 0.776761 0.349210
C -4.063947 -0.035945 -0.734431
C 4.424818 0.691360 0.959924
C 4.762387 -0.032196 -1.388543
C -3.644020 -1.320652 -0.386514
C -3.989526 3.321301 0.467437
C -2.725727 3.138893 -1.719878
C 1.122562 -1.616187 -0.344391
C -2.016833 -2.914543 0.654060
C 5.288151 -0.363397 1.651703
C 4.232832 -0.992923 -2.453950
H -0.292920 -1.478094 1.981343
H -0.273438 0.295551 2.163065
H -4.715936 2.391512 -1.341292
H -1.455163 1.741786 0.554305
H 2.819983 1.997660 -0.787430
H 2.241071 0.562141 -1.674574
H -5.003565 0.094718 -1.267963
H 5.027320 1.595823 0.729748
H 3.622351 1.023496 1.660422
H 5.019219 0.946313 -1.848938
H 5.709116 -0.442845 -0.967855
H -4.261864 -2.175455 -0.654845
H -4.698458 2.832403 1.144786
H -4.395663 4.304170 0.208128
H -3.064040 3.488417 1.031440
H -1.763356 3.301403 -1.219484
H -3.083032 4.114762 -2.063895
H -2.533549 2.520112 -2.602963
H 2.192506 -1.883409 -0.236274
H 0.508413 -2.484782 -0.037655
H 0.915427 -1.422479 -1.409998
H -2.617706 -3.676518 0.141333
H -0.962817 -3.097781 0.380509
H -2.119780 -3.097919 1.732969
H 4.714912 -1.283882 1.827550
H 6.163929 -0.638771 1.054069
H 5.643036 -0.000212 2.622198
H 3.952362 -1.956762 -2.009563
H 3.345110 -0.598347 -2.960934
H 4.994004 -1.186329 -3.217601


%chk=000200202-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000200202

0 1
O 1.180584 1.742934 1.482756
N 0.812397 -0.361336 0.552749
N 3.780960 0.147227 -0.248102
C -1.687027 -0.482561 0.773535
C -0.331735 -0.592137 1.473861
C -3.626669 2.324186 -1.082229
C -3.266177 0.966946 -0.471929
C -2.035046 0.763215 0.196564
C 2.644037 1.103077 -0.360794
C -2.595233 -1.580005 0.693040
C 1.495807 0.842404 0.632595
C -4.160958 -0.128301 -0.550213
C 4.404834 0.200503 1.108746
C 4.779383 0.364016 -1.335230
C -3.828312 -1.374601 0.023767
C -3.721925 3.430357 0.002766
C -2.627447 2.735364 -2.196915
C 1.047941 -1.385130 -0.480294
C -2.288261 -2.941699 1.301174
C 5.239531 -1.051002 1.436395
C 4.287061 -0.080917 -2.725819
H -0.200904 -1.585307 1.938789
H -0.249414 0.179763 2.259693
H -4.627596 2.224076 -1.549521
H -1.318973 1.589468 0.290240
H 2.959296 2.155376 -0.171778
H 2.245725 1.051820 -1.391504
H -5.124332 -0.004121 -1.060824
H 5.029965 1.121310 1.225511
H 3.588760 0.285557 1.848257
H 5.099387 1.437198 -1.374719
H 5.678032 -0.224878 -1.080018
H -4.538830 -2.207462 -0.048329
H -4.463781 3.166267 0.777861
H -4.019554 4.394897 -0.449734
H -2.747625 3.577442 0.504315
H -1.609561 2.867298 -1.785050
H -2.931633 3.693917 -2.657445
H -2.576512 1.968578 -2.991181
H 2.069537 -1.277357 -0.875537
H 0.964140 -2.388905 -0.022759
H 0.298717 -1.314959 -1.293104
H -3.105471 -3.652632 1.090592
H -1.355821 -3.379106 0.895901
H -2.171438 -2.888250 2.400287
H 4.620573 -1.959351 1.331484
H 6.120322 -1.157723 0.777888
H 5.609766 -0.996597 2.476856
H 3.985754 -1.143428 -2.706778
H 3.428657 0.516738 -3.081927
H 5.097665 0.035929 -3.468387


