%chk=000246945.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246945

0 1
O -0.436726 -3.852088 0.125649
O -0.114297 -2.837076 -1.844986
N 1.504448 -1.109872 -0.052081
C 0.126785 -1.556669 0.276842
C -0.978643 -0.508839 0.042750
C -2.331388 -0.971575 0.599016
C 2.102164 -0.236971 1.006840
C -3.390962 0.066664 0.342116
C -0.124041 -2.753076 -0.642738
C 3.295917 0.500564 0.450266
C -3.737033 0.987802 1.341818
C -4.034356 0.121497 -0.904197
C 4.351658 -0.214088 -0.135830
C 3.360476 1.898707 0.530229
C -4.719592 1.951340 1.096549
C -5.015032 1.086985 -1.143991
C -5.360221 2.003457 -0.145053
C 5.463020 0.467399 -0.637296
C 4.477373 2.575378 0.030578
C 5.528705 1.862431 -0.553507
H 0.102385 -1.912758 1.344853
H -1.072675 -0.281617 -1.040200
H -0.688035 0.449260 0.518971
H -2.625913 -1.939543 0.140484
H -2.247343 -1.184374 1.684566
H 1.525604 -0.637447 -0.965955
H 2.433690 -0.905760 1.838680
H 1.369604 0.473582 1.450759
H -3.243592 0.953859 2.310509
H -3.769449 -0.588589 -1.685776
H 4.295059 -1.301692 -0.203546
H 2.546361 2.462678 0.980504
H -4.986587 2.662922 1.876193
H -5.512303 1.125268 -2.112096
H -6.125046 2.753530 -0.333821
H 6.279759 -0.089533 -1.094153
H 4.526392 3.661053 0.095849
H -0.590385 -4.672051 -0.414234
H 6.396319 2.391341 -0.943066


%chk=000246945-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246945

0 1
O -0.391202 -3.721538 0.099170
O 0.193366 -2.725824 -1.914777
N 1.446682 -0.740506 -0.267112
C 0.172950 -1.359136 0.142994
C -1.093457 -0.455464 -0.046280
C -2.410543 -1.081392 0.489540
C 1.889247 0.443598 0.489040
C -3.576274 -0.107274 0.391784
C 0.013511 -2.633690 -0.680161
C 3.357263 0.776157 0.227631
C -3.945045 0.702305 1.496996
C -4.292362 0.043852 -0.824491
C 4.312669 -0.251359 0.025514
C 3.788595 2.125867 0.215393
C -4.997885 1.639802 1.391591
C -5.345919 0.978612 -0.935067
C -5.701947 1.782026 0.173573
C 5.674588 0.066369 -0.174313
C 5.151778 2.446051 0.020951
C 6.100338 1.415781 -0.174251
H 0.243254 -1.645134 1.209393
H -1.201528 -0.210259 -1.121171
H -0.910287 0.496733 0.487491
H -2.638512 -2.002438 -0.079971
H -2.257714 -1.389457 1.542304
H 1.528287 -0.645118 -1.287457
H 1.753908 0.208536 1.566384
H 1.279580 1.358790 0.295541
H -3.407421 0.592256 2.447463
H -4.024768 -0.579566 -1.687309
H 3.967205 -1.290550 0.017524
H 3.055363 2.930438 0.356754
H -5.271684 2.253591 2.257471
H -5.890626 1.078614 -1.880919
H -6.520529 2.505757 0.090432
H 6.403980 -0.736875 -0.330616
H 5.470896 3.494584 0.013873
H -0.500544 -4.523523 -0.483032
H 7.156886 1.661486 -0.330385


