%chk=000246930.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246930

0 1
O 1.458603 1.486863 0.651557
O 1.509860 0.679677 -1.461101
N 0.723484 -2.790286 -1.039900
C -1.151961 -0.122774 0.115196
C 0.301562 -0.569614 0.296260
C -1.697890 -0.286753 -1.278580
C -2.944975 0.575098 -1.519041
C -3.933659 0.433451 -0.356044
C -3.284551 0.877692 0.962747
C -1.873355 0.395690 1.118488
C 0.689076 -0.838656 1.774158
C 1.162962 0.559508 -0.312094
C 2.132631 -1.297016 1.940169
C 0.541615 -1.804659 -0.467588
C 2.249605 2.655895 0.252393
C 3.707635 2.270877 0.125785
H -0.921724 -0.035784 -2.034599
H -1.945325 -1.357551 -1.446956
H -2.650427 1.636056 -1.636760
H -3.425641 0.281721 -2.470871
H -4.265138 -0.620074 -0.273797
H -4.844554 1.028410 -0.550698
H -3.897328 0.526381 1.817942
H -3.284401 1.987732 1.026500
H -1.467548 0.525494 2.122575
H -0.002874 -1.597816 2.192422
H 0.530866 0.094692 2.357919
H 2.368628 -1.465177 2.998416
H 2.840913 -0.545220 1.567134
H 2.337821 -2.237505 1.413220
H 1.830919 3.058239 -0.687259
H 2.046269 3.335644 1.100035
H 4.341505 3.150502 -0.040129
H 4.073528 1.760766 1.025756
H 3.866871 1.588496 -0.723858


%chk=000246930-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246930

0 1
O 1.517500 1.491132 0.659596
O 1.499935 0.637103 -1.507802
N 0.697600 -2.855146 -1.066468
C -1.158752 -0.126101 0.105123
C 0.319511 -0.594186 0.314286
C -1.716959 -0.260938 -1.307754
C -2.979505 0.605090 -1.521518
C -3.968282 0.427633 -0.348020
C -3.318678 0.884154 0.978930
C -1.883564 0.410301 1.124109
C 0.692777 -0.890348 1.804276
C 1.193488 0.541037 -0.299311
C 2.120978 -1.438041 1.998334
C 0.541507 -1.830296 -0.478178
C 2.276401 2.691325 0.175468
C 3.778876 2.403384 0.137647
H -0.936041 0.010314 -2.045128
H -1.954908 -1.326511 -1.504687
H -2.688840 1.672262 -1.596593
H -3.458943 0.331748 -2.480055
H -4.250798 -0.641133 -0.272168
H -4.899465 0.996605 -0.529969
H -3.911287 0.520595 1.842470
H -3.338544 1.993269 1.049769
H -1.437364 0.524876 2.119552
H -0.048500 -1.612489 2.194126
H 0.584756 0.047567 2.373439
H 2.308743 -1.628776 3.070174
H 2.879403 -0.713907 1.649929
H 2.272491 -2.387458 1.454884
H 1.892119 2.964842 -0.822776
H 2.017543 3.467730 0.912612
H 4.325523 3.325312 -0.134373
H 4.141961 2.067142 1.124293
H 4.012322 1.631908 -0.614820


