%chk=000219651.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219651

0 1
I -2.726989 2.835492 -0.422258
O -3.770132 -0.876663 -0.753150
N -2.182985 -0.492147 0.854989
C 0.945409 -0.772075 0.445533
C 2.188041 -0.565707 -0.431715
C -0.185997 -1.444342 -0.340942
C 3.321115 0.110262 0.351515
C 4.564504 0.316198 -0.525292
C -1.425482 -1.725578 0.520790
C 5.696097 0.988853 0.248520
C -3.274247 -0.117687 0.060193
C -3.883318 1.227566 0.378288
H 1.208162 -1.385177 1.329390
H 0.605177 0.203822 0.841929
H 1.925996 0.045251 -1.317488
H 2.534595 -1.538942 -0.830045
H -0.468506 -0.819426 -1.212838
H 0.172050 -2.400769 -0.772356
H 3.584990 -0.498759 1.237400
H 2.978050 1.084964 0.748444
H 4.911126 -0.658184 -0.922018
H 4.303286 0.927253 -1.411507
H -2.107366 -2.428852 -0.018864
H -1.143720 -2.218206 1.477760
H 5.399166 1.974980 0.623166
H 6.578640 1.131438 -0.385267
H 6.006594 0.390207 1.112378
H -1.654884 0.219311 1.356495
H -4.008548 1.400830 1.459030
H -4.890322 1.293885 -0.081479


%chk=000219651-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000219651

0 1
I -2.963370 2.659964 1.800904
O -3.839786 -0.798445 -0.824787
N -2.151187 -0.438779 0.751302
C 0.930657 -0.750988 0.401059
C 2.241475 -0.683306 -0.415458
C -0.164769 -1.593629 -0.290188
C 3.337438 0.174222 0.256113
C 4.648144 0.237973 -0.561407
C -1.469183 -1.728306 0.529703
C 5.735267 1.105059 0.109434
C -3.268566 -0.073096 0.052455
C -3.922232 1.285781 0.319275
H 1.146668 -1.176385 1.404290
H 0.560365 0.282274 0.567534
H 2.021947 -0.274073 -1.423579
H 2.626292 -1.712432 -0.574859
H -0.407415 -1.159606 -1.279713
H 0.223364 -2.615734 -0.476827
H 3.556901 -0.231558 1.266061
H 2.954343 1.204655 0.411669
H 5.033740 -0.791253 -0.711454
H 4.426704 0.637028 -1.572365
H -2.186601 -2.378590 -0.000322
H -1.250055 -2.182411 1.515752
H 5.385820 2.146623 0.240939
H 6.661096 1.133249 -0.494148
H 5.996029 0.710749 1.109884
H -1.759810 0.224351 1.425779
H -4.943104 1.131523 0.700065
H -3.959669 1.862938 -0.616510


