%chk=000271809.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000271809

0 1
O 0.691554 0.066338 1.945737
O 2.631693 -2.251202 -2.459523
N -3.232579 0.486052 0.136188
C -1.183798 -0.494037 -0.132069
C -2.195092 -1.525795 -0.231456
C -1.842586 0.715334 0.092577
C -3.467674 -0.889933 -0.051171
C 0.244297 -0.723271 -0.268969
C -1.324662 2.082197 0.228927
C 1.135204 -0.290003 0.876232
C -2.148513 -2.916238 -0.442422
C 2.611646 -0.349996 0.628893
C 0.763899 -1.335675 -1.345172
C -4.676221 -1.611977 -0.081732
C 3.132306 -0.980893 -0.515739
C 2.213924 -1.593594 -1.529669
C -3.338895 -3.623255 -0.473478
C -4.589783 -2.977137 -0.295105
C -1.408044 2.969360 -0.856193
C -0.757135 2.502132 1.440782
C 3.480965 0.219052 1.564737
C 4.514078 -1.039353 -0.714366
C 4.866260 0.164755 1.358912
C 5.381303 -0.462910 0.223918
C -0.925854 4.273621 -0.723434
C -0.278650 3.809076 1.565848
C -0.363767 4.694727 0.486876
H -3.930698 1.186906 0.299990
H -1.189429 -3.413230 -0.574725
H 0.132040 -1.678060 -2.172455
H -5.629534 -1.113920 0.058529
H -3.328070 -4.699787 -0.636123
H -5.496973 -3.579621 -0.327269
H -1.839099 2.637032 -1.799894
H -0.676937 1.797601 2.275653
H 3.069842 0.700170 2.456909
H 4.907547 -1.539355 -1.604744
H 5.539283 0.612083 2.090658
H 6.458829 -0.508855 0.063973
H -0.985707 4.962483 -1.564633
H 0.163164 4.135282 2.506454
H 0.010267 5.712593 0.587248


%chk=000271809-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000271809

0 1
O 0.852249 0.307550 1.933251
O 2.632706 -2.460280 -2.442077
N -3.175871 0.478491 0.185873
C -1.125449 -0.492995 -0.038341
C -2.156946 -1.508741 -0.252217
C -1.797747 0.723256 0.235781
C -3.431790 -0.869675 -0.089008
C 0.314489 -0.718834 -0.192651
C -1.356777 2.143272 0.348804
C 1.275713 -0.200471 0.847643
C -2.123202 -2.903280 -0.515677
C 2.741713 -0.367912 0.603099
C 0.813072 -1.489556 -1.229961
C -4.655044 -1.564863 -0.187172
C 3.216101 -1.131970 -0.500170
C 2.242066 -1.753880 -1.450404
C -3.339355 -3.606989 -0.620291
C -4.592327 -2.946172 -0.463340
C -1.582356 3.009383 -0.758028
C -0.798701 2.679136 1.538301
C 3.668092 0.218632 1.500428
C 4.606740 -1.304623 -0.694455
C 5.053222 0.051299 1.297179
C 5.523664 -0.712236 0.198728
C -1.242033 4.377845 -0.681690
C -0.465801 4.049717 1.613409
C -0.683621 4.902619 0.506820
H -3.876703 1.201534 0.342762
H -1.170541 -3.430979 -0.627644
H 0.139144 -1.902137 -1.988734
H -5.617466 -1.059247 -0.051909
H -3.324624 -4.682887 -0.825218
H -5.520189 -3.521535 -0.552847
H -2.005468 2.601291 -1.683534
H -0.621118 2.014721 2.387100
H 3.280637 0.793328 2.347550
H 4.938736 -1.903700 -1.548513
H 5.767295 0.508892 1.990194
H 6.600340 -0.843090 0.045434
H -1.408713 5.029550 -1.546512
H -0.035354 4.449698 2.538036
H -0.420381 5.964534 0.568700


