%chk=000296693.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296693

0 1
O 4.017947 -1.549829 -1.579293
O -2.321234 0.471724 2.172892
N -0.433292 -0.255030 1.073703
C 1.720766 0.458572 0.334161
C 0.236686 0.644164 0.445026
C -0.303163 1.865039 -0.217701
C 2.235540 -0.472998 -0.563871
C 2.568411 1.246648 1.130407
C 3.637314 -0.604396 -0.653464
C 0.071601 2.168881 -1.535504
C -1.176760 2.713570 0.478229
C 3.950918 1.090897 1.022597
C 4.505219 0.167782 0.128388
C -2.554572 -1.471255 0.791629
C -0.434194 3.313635 -2.155388
C -1.672460 3.861826 -0.145267
C -1.825016 -0.316240 1.390302
C -1.304085 4.161563 -1.460490
C -1.888834 -2.615441 0.330413
C -3.955119 -1.390934 0.713945
C -2.623569 -3.670353 -0.219178
C -4.682550 -2.445641 0.159891
C -4.016558 -3.584640 -0.307522
C 5.434144 -1.801857 -1.747136
H 1.593746 -1.104189 -1.174172
H 2.146928 1.966119 1.829396
H 0.756249 1.512451 -2.074080
H -1.476159 2.472765 1.505134
H 4.612449 1.696891 1.643120
H 5.581825 0.061692 0.056953
H -0.148474 3.547313 -3.179740
H -2.349838 4.520897 0.396580
H -1.694231 5.055750 -1.944992
H -0.800891 -2.686718 0.408200
H -4.465122 -0.502781 1.095574
H -2.108296 -4.560567 -0.576254
H -5.767616 -2.383385 0.096116
H -4.585888 -4.407937 -0.738193
H 5.868082 -2.171224 -0.813489
H 5.940481 -0.901766 -2.106790
H 5.431514 -2.585899 -2.516032


%chk=000296693-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000296693

0 1
O 4.160234 -2.287009 -0.260428
O -2.004183 0.048139 2.416975
N -0.297601 -0.297097 0.857163
C 1.797006 0.534808 0.020985
C 0.333259 0.703039 0.296957
C -0.352430 1.974630 -0.112551
C 2.349192 -0.767128 -0.015055
C 2.649395 1.661811 -0.157384
C 3.732082 -0.952033 -0.235614
C -0.133812 2.517358 -1.409263
C -1.255639 2.628698 0.771029
C 4.028605 1.467431 -0.367642
C 4.584568 0.168508 -0.415354
C -2.419816 -1.492340 0.581330
C -0.814753 3.682634 -1.820158
C -1.917336 3.806000 0.360716
C -1.590199 -0.492224 1.338811
C -1.704658 4.333987 -0.933871
C -1.924760 -2.180169 -0.556840
C -3.749573 -1.725646 1.018536
C -2.753672 -3.086012 -1.252658
C -4.575442 -2.632091 0.323118
C -4.079975 -3.313458 -0.814986
C 5.590586 -2.540594 -0.451949
H 1.705888 -1.637104 0.143990
H 2.239251 2.674104 -0.105307
H 0.552384 2.013656 -2.098826
H -1.425926 2.216556 1.770643
H 4.686128 2.334700 -0.492331
H 5.657906 0.043249 -0.585961
H -0.651283 4.081740 -2.827246
H -2.601762 4.307999 1.053014
H -2.226799 5.244007 -1.250048
H -0.893008 -2.011337 -0.882720
H -4.105760 -1.184583 1.901474
H -2.367856 -3.618073 -2.129269
H -5.601728 -2.809166 0.663340
H -4.722034 -4.018579 -1.355099
H 6.191826 -2.089635 0.361319
H 5.941442 -2.158507 -1.430541
H 5.692155 -3.635170 -0.424202


