%chk=000180113.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180113

0 1
O -3.223360 0.363448 -1.212203
N 0.877303 -0.883784 0.636313
C 2.038609 0.036358 0.364718
C 0.060154 -0.849304 -0.629608
C 2.350127 -0.082902 -1.152135
C 1.042217 -0.563687 -1.804453
C 1.625585 1.460454 0.793269
C -0.969474 0.246942 -0.468828
C 0.651451 2.174261 -0.154428
C -0.703777 1.544045 -0.253478
C 1.323357 -2.266170 0.976580
C -2.404422 -0.187361 -0.507357
C -2.778777 -1.325625 0.400006
H 2.925107 -0.265569 0.970416
H -0.447457 -1.828855 -0.796749
H 3.166299 -0.803107 -1.323360
H 2.690590 0.874959 -1.575232
H 0.628857 0.190879 -2.493711
H 1.204129 -1.472711 -2.404030
H 2.537495 2.077691 0.902670
H 1.165655 1.399135 1.802848
H 1.089466 2.231283 -1.176180
H 0.547865 3.228470 0.178975
H -1.532800 2.255284 -0.154525
H 1.903347 -2.231316 1.913030
H 1.934273 -2.760015 0.207048
H 0.436874 -2.890021 1.172467
H -2.782942 -2.279597 -0.142868
H -3.794941 -1.189114 0.797102
H -2.091109 -1.426071 1.252003


%chk=000180113-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000180113

0 1
O -3.387854 0.826501 -0.195450
N 0.985683 -0.823375 0.773130
C 2.102782 0.088091 0.365161
C 0.034740 -0.818286 -0.390824
C 2.332129 -0.202911 -1.156644
C 0.932881 -0.641691 -1.688318
C 1.762989 1.568418 0.667959
C -1.021202 0.280322 -0.254252
C 0.673642 2.231680 -0.218143
C -0.705922 1.611389 -0.177438
C 1.448515 -2.188814 1.126610
C -2.489137 -0.069677 -0.182232
C -2.900000 -1.538266 -0.077806
H 2.997535 -0.171799 0.961700
H -0.465089 -1.799594 -0.420401
H 3.066073 -1.020483 -1.274494
H 2.729197 0.677294 -1.693819
H 0.495762 0.108397 -2.369207
H 0.998546 -1.591719 -2.247040
H 2.692155 2.164024 0.557492
H 1.452142 1.630462 1.727041
H 1.026977 2.246690 -1.273208
H 0.593192 3.294458 0.077815
H -1.561844 2.296781 -0.089407
H 2.147926 -2.123809 1.978766
H 1.963178 -2.737860 0.299551
H 0.584357 -2.795422 1.451455
H -2.611626 -2.102448 -0.985414
H -3.993210 -1.590651 0.039534
H -2.414818 -2.029703 0.786181


