%chk=000194674.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000194674

0 1
O 1.115937 1.988151 -1.704803
O -0.283622 -1.619279 -1.615637
O 0.946510 1.831188 1.504116
O 3.643663 -1.755923 0.694661
N 1.634696 -1.688472 -0.435084
N 2.276314 0.060394 1.080021
C 0.068109 0.282035 -0.146880
C -0.089302 1.274431 -1.303791
C -1.284143 0.142335 0.651028
C 0.015356 2.761033 -1.118166
C -2.471016 -0.192700 -0.268202
C 0.413964 -1.060689 -0.799316
C 1.096537 0.816702 0.859239
C -1.124476 -0.901527 1.757569
C -3.815033 -0.058696 0.462113
C 2.609847 -1.173161 0.460130
C -4.986772 -0.360643 -0.468463
H -0.663553 0.866811 -2.151121
H -1.468352 1.145511 1.121563
H -0.477817 3.438248 -1.812598
H 0.241319 3.193976 -0.139649
H -2.363149 -1.219557 -0.678637
H -2.477418 0.469600 -1.155413
H -2.050864 -0.985452 2.345087
H -0.331283 -0.646362 2.469273
H -0.919671 -1.904433 1.364588
H -3.921565 0.962587 0.878151
H -3.844857 -0.745958 1.331540
H 1.863247 -2.586153 -0.896395
H 2.978678 0.454039 1.730070
H -5.023185 0.332946 -1.316331
H -4.925814 -1.375202 -0.880487
H -5.943383 -0.280278 0.060721


%chk=000194674-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000194674

0 1
O 1.168805 1.923332 -1.753268
O -0.177564 -1.769895 -1.543229
O 0.871758 1.912761 1.484592
O 3.839058 -1.577669 0.768012
N 1.777677 -1.647715 -0.331168
N 2.319417 0.172548 1.068341
C 0.094358 0.222039 -0.125990
C -0.067646 1.162703 -1.343721
C -1.282363 0.067726 0.663807
C -0.066597 2.653648 -1.256089
C -2.511984 -0.126940 -0.261805
C 0.530670 -1.133584 -0.718578
C 1.108709 0.846859 0.857281
C -1.164498 -1.045371 1.733592
C -3.855966 -0.145792 0.506385
C 2.728127 -1.052242 0.516477
C -5.067519 -0.129092 -0.450957
H -0.583493 0.682060 -2.184033
H -1.398885 1.040053 1.183749
H -0.595730 3.223823 -2.029208
H 0.061613 3.136130 -0.281388
H -2.401463 -1.058438 -0.847296
H -2.554273 0.705916 -0.991837
H -2.039113 -1.028944 2.404895
H -0.269016 -0.912919 2.369356
H -1.118304 -2.047782 1.268093
H -3.908153 0.729532 1.186648
H -3.915293 -1.046745 1.146597
H 2.059037 -2.538849 -0.754106
H 2.993878 0.623963 1.695167
H -5.074424 0.788221 -1.069478
H -5.040539 -0.995637 -1.137953
H -6.021384 -0.168200 0.106010


