%chk=000263405.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000263405

0 1
O 4.998193 -3.303081 -0.358012
O -5.285789 1.713881 -0.163327
O -3.340677 2.645465 -0.128234
O -4.147234 -4.333574 0.100267
O -5.865311 -3.023282 -0.021585
N 0.185165 1.030379 0.077960
N -1.180343 1.242123 -0.003222
N -4.072338 1.648104 -0.117714
N -4.663732 -3.229531 0.036393
C 2.932238 0.336399 -0.166271
C 3.154485 -0.448332 1.144910
C 4.215726 0.338314 -1.024272
C 4.859862 -1.895147 -0.034479
C 3.607943 -1.880974 0.856148
C 4.662041 -1.093954 -1.332016
C 2.465087 1.743572 0.151069
C 1.012386 2.043926 0.036343
C 3.309807 2.709194 0.554950
C 0.653382 3.506195 -0.090039
C 2.915239 4.120995 0.856047
C 1.398210 4.314389 0.979719
C 6.304320 -3.695006 -0.809933
C -2.019720 0.152354 0.015122
C -3.443560 0.342161 -0.046974
C -1.515430 -1.191753 0.087554
C -4.299354 -0.783060 -0.039609
C -2.360931 -2.266347 0.093934
C -3.773396 -2.063323 0.028928
H 2.139516 -0.195425 -0.755819
H 2.213778 -0.463338 1.729654
H 3.900192 0.067952 1.777631
H 5.029256 0.879132 -0.504623
H 4.034542 0.887971 -1.966891
H 5.758395 -1.552291 0.518401
H 2.802495 -2.457335 0.357278
H 3.814425 -2.424561 1.797383
H 5.594231 -1.086660 -1.924343
H 3.912424 -1.611021 -1.963924
H 4.377908 2.504035 0.666678
H -0.437341 3.691844 -0.009465
H 0.937838 3.858935 -1.106116
H 3.316241 4.776853 0.051220
H 3.411404 4.461736 1.789240
H 1.140070 5.387170 0.891701
H 1.059214 4.000259 1.987683
H 6.194914 -4.778217 -0.948905
H 7.059027 -3.479038 -0.048411
H 6.547256 -3.209192 -1.758757
H -1.579889 2.215300 -0.045973
H -0.429162 -1.334966 0.138583
H -5.393365 -0.629536 -0.088802
H -1.982041 -3.296195 0.148421


%chk=000263405-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000263405

0 1
O 4.992923 -3.430109 -0.100754
O -5.309630 1.727995 0.316045
O -3.236647 2.673512 0.355135
O -4.163585 -4.394695 -0.470981
O -5.958822 -2.997322 -0.246089
N 0.250199 0.977463 0.032719
N -1.119151 1.186234 0.119134
N -4.028162 1.621966 0.258520
N -4.687171 -3.221235 -0.311831
C 2.973573 0.389867 -0.235604
C 3.042117 -0.399314 1.108875
C 4.334335 0.281043 -0.966563
C 4.766242 -1.988641 0.101962
C 3.442623 -1.874507 0.875954
C 4.703797 -1.199914 -1.225755
C 2.486579 1.821833 -0.006529
C 1.036488 2.045235 0.179265
C 3.331842 2.906442 0.000523
C 0.518006 3.455706 0.451118
C 2.896910 4.328578 0.279619
C 1.589520 4.361889 1.095161
C 6.341073 -3.762161 -0.557550
C -1.985792 0.123106 0.014072
C -3.419645 0.307244 0.079943
C -1.493992 -1.213037 -0.164232
C -4.300426 -0.791743 -0.026542
C -2.363192 -2.293775 -0.270226
C -3.769601 -2.074235 -0.199862
H 2.211791 -0.117780 -0.861468
H 2.062774 -0.354531 1.618441
H 3.779433 0.094057 1.775393
H 5.135253 0.743225 -0.351789
H 4.303087 0.835273 -1.924592
H 5.596522 -1.574092 0.725371
H 2.657593 -2.393082 0.290069
H 3.536105 -2.411363 1.837704
H 5.673259 -1.254953 -1.756829
H 3.942740 -1.673868 -1.877175
H 4.395204 2.750002 -0.215585
H -0.371151 3.427095 1.111406
H 0.180501 3.901839 -0.509232
H 2.760723 4.871349 -0.681672
H 3.701088 4.867942 0.815797
H 1.202954 5.394128 1.175692
H 1.795711 4.006148 2.122665
H 6.410001 -4.861314 -0.524992
H 7.114210 -3.326254 0.112063
H 6.532592 -3.419417 -1.595098
H -1.577796 2.113534 0.236439
H -0.411789 -1.345443 -0.212980
H -5.380469 -0.633141 0.026478
H -1.993148 -3.313279 -0.406134


