%chk=000222985.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222985

0 1
O 4.000272 2.207820 0.002022
O 5.367912 0.435498 -1.064473
O -5.328380 -0.599433 1.214087
O -5.057817 0.628749 -1.356652
N 1.871396 -2.891730 0.164555
C 0.561196 -1.316925 1.172715
C 1.741785 -0.662931 0.666777
C -0.558124 -0.665490 1.902746
C 2.544551 -1.669314 0.041644
C 0.660876 -2.665872 0.853246
C -1.724326 -0.332193 1.006398
C 2.189330 0.679465 0.683460
C 3.789970 -1.382495 -0.569345
C 3.398439 0.968144 0.091502
C 4.203196 -0.067194 -0.537271
C -3.030410 -0.600649 1.443518
C -1.520493 0.266879 -0.241671
C -4.124076 -0.270857 0.633396
C -2.606208 0.599773 -1.059518
C -3.908312 0.336824 -0.632911
C 3.301713 3.317572 0.615260
C 6.260026 -0.503232 -1.714520
C -6.542152 -0.318196 0.473800
C -4.880630 1.198847 -2.674630
H -0.202766 0.272114 2.388289
H -0.884370 -1.316943 2.743343
H -0.030076 -3.462941 1.056802
H 2.186137 -3.773596 -0.183598
H 1.574580 1.438287 1.156161
H 4.370235 -2.169518 -1.030906
H -3.220467 -1.067011 2.408706
H -0.505674 0.466935 -0.587158
H -2.418410 1.061882 -2.025042
H 3.986784 4.149626 0.406568
H 3.197771 3.156399 1.691860
H 2.334263 3.475375 0.130585
H 7.081104 0.156062 -2.026132
H 5.770870 -0.956738 -2.580849
H 6.609613 -1.254061 -1.000638
H -6.545856 -0.878155 -0.467227
H -6.627812 0.757995 0.288917
H -7.315061 -0.675148 1.162825
H -4.327585 0.509010 -3.318570
H -4.389401 2.173619 -2.605153
H -5.918914 1.305446 -3.012418


%chk=000222985-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000222985

0 1
O 2.709408 2.361442 0.029224
O 4.873039 1.134929 -0.816250
O -4.027645 1.622931 1.368448
O -4.355613 1.308709 -1.447606
N 2.583095 -3.226935 0.168859
C 0.671412 -2.236226 0.944297
C 1.608351 -1.199071 0.543774
C -0.694545 -2.034897 1.559884
C 2.791515 -1.845110 0.065870
C 1.301423 -3.457242 0.698505
C -1.653099 -1.169529 0.735750
C 1.547510 0.222377 0.543914
C 3.915705 -1.122162 -0.399885
C 2.651610 0.958509 0.083532
C 3.841862 0.284670 -0.387236
C -2.450985 -0.185053 1.366529
C -1.792037 -1.345041 -0.660384
C -3.358823 0.617755 0.643319
C -2.693844 -0.553249 -1.404373
C -3.475411 0.441194 -0.769489
C 1.520889 3.081214 0.486378
C 6.099150 0.500149 -1.292841
C -5.494660 1.712972 1.222609
C -4.416554 1.197012 -2.906205
H -0.589080 -1.575456 2.563812
H -1.155168 -3.029430 1.730010
H 0.935718 -4.469037 0.866158
H 3.249531 -3.947840 -0.095487
H 0.639670 0.726450 0.885205
H 4.812273 -1.636333 -0.758193
H -2.381861 -0.011184 2.446624
H -1.174207 -2.090840 -1.172766
H -2.767980 -0.703327 -2.485930
H 1.763800 4.146379 0.357750
H 1.306507 2.872131 1.553353
H 0.631156 2.822815 -0.121337
H 6.764139 1.332270 -1.567427
H 5.909202 -0.134215 -2.182153
H 6.574300 -0.111080 -0.499224
H -5.971084 0.758428 1.520857
H -5.775428 1.966168 0.187397
H -5.798524 2.513082 1.915135
H -4.799531 0.206718 -3.221616
H -3.423655 1.373230 -3.363399
H -5.116831 1.983423 -3.224892


