%chk=000253293.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253293

0 1
O 0.960711 1.482682 -0.097902
O -0.627248 -1.547280 0.607299
O -3.591995 -0.586283 -1.188140
O -0.316866 2.317023 1.561632
O -1.142111 -1.721373 -1.593667
N 3.807269 -0.436372 0.955002
C 2.311532 -0.244348 0.984134
C 1.677059 -1.108622 -0.143158
C 2.071190 1.282950 0.823265
C 2.860137 -1.777107 -0.875419
C 4.082838 -1.589431 0.040875
C 4.440716 0.855982 0.515255
C 3.324608 1.849493 0.147791
C 0.693096 -2.146786 0.395466
C -2.890764 -0.998852 -0.013333
C -0.257378 1.887490 0.431235
C -2.866772 0.229864 0.936758
C -1.465267 -1.427965 -0.465580
C -2.700779 1.548709 0.150026
C -1.362153 1.678736 -0.529528
C -3.540059 -2.259384 0.556273
C -4.138959 0.316937 1.783551
C -1.253463 1.615764 -1.867972
C -0.009327 1.734802 -2.664779
H 1.958486 -0.578222 1.988796
H 1.119750 -0.448593 -0.860513
H 1.836385 1.775021 1.791721
H 3.022181 -1.289280 -1.852964
H 2.677357 -2.840554 -1.096688
H 4.228670 -2.477735 0.693911
H 5.019046 -1.456692 -0.530894
H 5.156305 0.721536 -0.316264
H 5.023488 1.221557 1.389372
H 3.549405 2.873293 0.486321
H 3.173700 1.908405 -0.946319
H 0.573751 -3.004384 -0.290713
H 0.928537 -2.498289 1.416497
H -1.988151 0.100241 1.624739
H -2.832748 2.405358 0.848620
H -3.523926 1.631657 -0.593262
H -4.620910 -2.108627 0.688400
H -3.425101 -3.126115 -0.105520
H -3.115340 -2.527323 1.532357
H -4.142671 1.230100 2.393107
H -5.039394 0.336485 1.156898
H -4.228255 -0.523902 2.479512
H -2.159609 1.440597 -2.466491
H -3.486211 -1.244517 -1.915248
H 0.315943 0.736556 -3.006965
H 0.836905 2.156263 -2.095246
H -0.151710 2.355736 -3.559049


%chk=000253293-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000253293

0 1
O 0.974656 1.609854 -0.283470
O -0.533368 -1.478540 0.499310
O -3.720114 -0.661053 -1.149434
O -0.273545 1.888099 1.666439
O -1.219235 -1.535814 -1.729431
N 3.743648 -0.371718 1.152481
C 2.274522 -0.175439 0.901138
C 1.858253 -1.150462 -0.270789
C 2.162705 1.335226 0.556238
C 3.172911 -1.919158 -0.626834
C 4.068855 -1.724467 0.632062
C 4.496148 0.783032 0.535491
C 3.447551 1.632359 -0.232154
C 0.761397 -2.147268 0.131844
C -2.879293 -0.986407 0.011981
C -0.240723 1.781398 0.412966
C -2.948015 0.206471 1.021298
C -1.457102 -1.301351 -0.514638
C -2.750887 1.587715 0.323729
C -1.451847 1.762275 -0.452642
C -3.380416 -2.323487 0.633182
C -4.299304 0.238066 1.775163
C -1.471245 1.901872 -1.816984
C -0.353278 2.102251 -2.805573
H 1.683380 -0.403928 1.805799
H 1.489863 -0.573152 -1.135976
H 2.089877 1.929957 1.483294
H 3.653000 -1.460559 -1.510619
H 2.995430 -2.985024 -0.864403
H 3.815530 -2.478791 1.402719
H 5.149206 -1.811725 0.424865
H 5.302907 0.419991 -0.129703
H 4.968089 1.383712 1.336127
H 3.693418 2.706709 -0.256566
H 3.328031 1.278150 -1.272804
H 0.551450 -2.848798 -0.695155
H 1.026383 -2.698485 1.050856
H -2.133780 0.062550 1.756547
H -2.791963 2.351806 1.123117
H -3.604425 1.751344 -0.356093
H -4.466647 -2.250856 0.798555
H -3.198996 -3.165219 -0.059889
H -2.875053 -2.535404 1.591286
H -4.347865 1.139592 2.412737
H -5.144360 0.274558 1.063786
H -4.434163 -0.637251 2.433363
H -2.472770 1.844782 -2.270036
H -3.258855 -1.022347 -1.956398
H -0.145986 1.141578 -3.322190
H 0.580668 2.437019 -2.334680
H -0.662745 2.821538 -3.586714


