%chk=000245846.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245846

0 1
O -0.106220 1.636122 0.659254
O -2.794917 0.135973 0.345886
O 0.958725 1.450803 -1.355708
N 2.058122 1.076243 0.702038
C -1.358591 2.009154 -0.030788
C -1.972122 0.760183 -0.680274
C -2.184338 2.610105 1.086937
C -3.360078 -1.088469 0.058387
C 0.993352 1.388303 -0.143832
C 3.384370 0.757312 0.263331
C -3.238267 -1.778298 -1.152928
C -4.111185 -1.599557 1.138237
C 4.332075 0.446732 1.260027
C 3.741704 0.752572 -1.095140
C -3.887939 -3.012719 -1.278326
C -4.744757 -2.827286 0.981187
C -4.636913 -3.537942 -0.224676
C 5.637328 0.132976 0.879354
C 5.053862 0.435230 -1.449614
C 6.003581 0.125640 -0.470691
H -1.085839 2.749335 -0.820218
H -2.627676 1.027894 -1.528415
H -1.190265 0.050395 -1.010560
H -1.663256 3.446008 1.569439
H -3.154933 2.964441 0.718444
H -2.392776 1.858569 1.868055
H 1.872614 1.062077 1.710570
H -2.659323 -1.386048 -1.981069
H -4.177726 -1.031758 2.062054
H 4.059971 0.448037 2.312198
H 3.004377 0.993458 -1.867599
H -3.803525 -3.565627 -2.214105
H -5.329981 -3.242027 1.802026
H -5.136800 -4.496505 -0.333802
H 6.375848 -0.108465 1.643888
H 5.336645 0.429991 -2.502800
H 7.023153 -0.120250 -0.757767


%chk=000245846-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245846

0 1
O -0.125729 1.681643 0.633997
O -2.604320 0.022043 0.464349
O 0.989346 1.532843 -1.442204
N 2.045633 1.073797 0.634879
C -1.383066 2.057265 -0.082463
C -2.066764 0.807804 -0.650779
C -2.226668 2.833454 0.928537
C -3.274251 -1.173785 0.155668
C 0.992942 1.430807 -0.187761
C 3.377193 0.741669 0.259612
C -3.470557 -1.665449 -1.159241
C -3.768755 -1.895277 1.271134
C 4.278378 0.391017 1.300671
C 3.823763 0.749588 -1.088339
C -4.166368 -2.883626 -1.344077
C -4.459668 -3.105742 1.069115
C -4.664057 -3.608930 -0.240033
C 5.612259 0.050786 0.998626
C 5.163047 0.405668 -1.372393
C 6.064830 0.055286 -0.341538
H -1.093944 2.686945 -0.946229
H -2.891538 1.125931 -1.323559
H -1.340165 0.211139 -1.235327
H -1.679804 3.725204 1.277254
H -3.171361 3.161393 0.458565
H -2.472927 2.196711 1.792542
H 1.816271 1.044120 1.631015
H -3.092122 -1.123823 -2.031124
H -3.600011 -1.491944 2.274525
H 3.934217 0.383719 2.342875
H 3.129022 1.019814 -1.886088
H -4.315793 -3.263048 -2.361351
H -4.839426 -3.659082 1.935338
H -5.201071 -4.550760 -0.393240
H 6.296587 -0.218077 1.810858
H 5.502125 0.413077 -2.414443
H 7.101052 -0.209579 -0.576370


