%chk=000298370.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298370

0 1
O 5.698338 -0.180383 -0.080783
O -2.335589 -0.354674 -2.117683
O -6.194337 0.398991 0.236688
N -4.248281 0.015340 -0.964723
N -4.199271 0.598748 1.363098
N -0.694500 0.200192 0.363775
C 1.557663 -0.089199 -0.411980
C -2.105577 0.224312 0.223655
C 2.398694 -0.398654 -1.505253
C 2.130227 0.199948 0.837151
C 4.325715 -0.123924 -0.086879
C 0.101172 -0.082027 -0.627311
C 3.776652 -0.418926 -1.355418
C 3.516164 0.185799 1.012889
C -2.813517 -0.064075 -1.041361
C -2.804862 0.539292 1.359741
C -4.983469 0.337889 0.195433
C 6.386016 0.104776 1.162201
H 1.960491 -0.624561 -2.479588
H 1.481146 0.439588 1.684285
H -0.220585 -0.327677 -1.659895
H 4.441207 -0.654537 -2.183821
H 3.939497 0.411698 1.985260
H -2.294246 0.756958 2.310348
H -4.787722 -0.177751 -1.822852
H -4.705449 0.835303 2.221075
H 6.109969 -0.628261 1.925496
H 6.180101 1.129566 1.483964
H 7.437451 -0.011250 0.867089


%chk=000298370-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000298370

0 1
O 5.781785 -0.178298 -0.072897
O -2.399829 -0.369643 -2.178081
O -6.296344 0.422560 0.287601
N -4.298120 0.035824 -0.900187
N -4.218669 0.601275 1.366891
N -0.716933 0.189599 0.333907
C 1.561048 -0.101652 -0.450062
C -2.113601 0.214953 0.196362
C 2.420691 -0.410704 -1.545621
C 2.150440 0.190455 0.810956
C 4.383965 -0.133868 -0.123910
C 0.110132 -0.093580 -0.656593
C 3.814555 -0.428038 -1.390222
C 3.546011 0.177238 0.982733
C -2.880138 -0.064288 -1.047330
C -2.835547 0.533552 1.339897
C -5.039044 0.356377 0.246235
C 6.431728 0.116190 1.208767
H 1.981818 -0.637787 -2.524856
H 1.484848 0.426842 1.647362
H -0.250166 -0.332714 -1.671277
H 4.483475 -0.663631 -2.223187
H 3.972245 0.405810 1.964257
H -2.299755 0.743089 2.268176
H -4.845014 -0.152694 -1.747340
H -4.717296 0.838895 2.226351
H 6.130073 -0.610426 1.987595
H 6.201438 1.144419 1.548146
H 7.509303 0.022744 1.010927


