%chk=000212598.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212598

0 1
O 0.066411 0.808806 0.453359
O 1.086495 -1.681726 0.838831
N -2.765634 3.090498 0.229597
C -2.014597 1.845772 0.586965
C -0.533456 2.137917 0.303163
C 1.415181 0.688506 0.272033
C 1.910696 -0.637924 0.402804
C -3.865961 3.352340 1.203129
C -3.305420 3.009029 -1.160067
C 2.305514 1.726281 -0.025783
C 3.264332 -0.916553 0.236229
C 3.667098 1.436398 -0.184859
C 4.146884 0.132646 -0.055750
C 0.147584 -2.192205 -0.051931
C 0.081804 -1.875199 -1.412981
C -0.726010 -3.115565 0.551877
C -0.893926 -2.508745 -2.188631
C -1.685252 -3.730939 -0.248398
C -1.773454 -3.431439 -1.615671
H -2.332696 0.940299 0.024077
H -2.139318 1.585427 1.660019
H -0.086790 2.822126 1.041759
H -0.353054 2.497517 -0.722391
H -4.362012 4.299431 0.934392
H -3.431815 3.491508 2.206726
H -4.633196 2.566544 1.260182
H -3.741569 3.985250 -1.427746
H -4.071310 2.234823 -1.315430
H -2.478101 2.819927 -1.862345
H 1.958985 2.750330 -0.127497
H 3.619503 -1.941379 0.344350
H 4.358400 2.248221 -0.412551
H 5.207018 -0.076659 -0.180619
H 0.765481 -1.156214 -1.854305
H -0.638173 -3.327862 1.614027
H -0.964128 -2.279154 -3.251485
H -2.373428 -4.451234 0.193307
H -2.525987 -3.919598 -2.228587


%chk=000212598-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000212598

0 1
O 0.062700 0.713444 0.417961
O 1.223193 -1.772523 0.815840
N -2.812578 3.089262 0.324863
C -2.069468 1.823046 0.523067
C -0.572300 2.035135 0.258806
C 1.441312 0.621289 0.222562
C 2.010603 -0.677705 0.381771
C -4.019493 3.193785 1.170026
C -3.111032 3.371166 -1.094996
C 2.288883 1.706949 -0.106945
C 3.395476 -0.872344 0.237428
C 3.680251 1.501439 -0.258089
C 4.239338 0.217469 -0.082863
C 0.188191 -2.280026 -0.009239
C 0.067191 -1.976159 -1.383919
C -0.703337 -3.176660 0.620991
C -0.970805 -2.580037 -2.129056
C -1.733164 -3.772436 -0.137129
C -1.874803 -3.477305 -1.514872
H -2.441191 0.993692 -0.125190
H -2.191521 1.493593 1.570039
H -0.153624 2.754883 0.988443
H -0.389478 2.413942 -0.767037
H -4.465650 4.197984 1.052045
H -3.745735 3.066770 2.232111
H -4.806678 2.438246 0.920484
H -3.552712 4.379500 -1.187342
H -3.824912 2.635739 -1.545554
H -2.184864 3.355422 -1.695425
H 1.874865 2.711928 -0.230712
H 3.793020 -1.881353 0.384377
H 4.323491 2.352443 -0.507020
H 5.316916 0.060452 -0.193250
H 0.769564 -1.286242 -1.862420
H -0.576678 -3.388348 1.686920
H -1.067785 -2.348755 -3.196060
H -2.426087 -4.468044 0.349553
H -2.674999 -3.942442 -2.100368


