%chk=000288592.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000288592

0 1
O -3.270876 -1.410320 1.130962
N -2.392729 -0.557523 -0.855442
N -1.050908 -0.439567 1.088763
C -0.163670 -0.023991 -0.064142
C -1.008695 -0.370125 -1.379384
C -2.200967 -0.771953 0.574014
C -3.327028 -1.623095 -1.308671
C 0.156236 1.465849 -0.015413
C 1.137876 -0.812377 0.023031
C -4.075699 -1.958762 0.005068
C 0.879914 2.049836 -1.068690
C 1.645735 -1.182474 1.278009
C -0.241882 2.261000 1.067186
C 1.860977 -1.139704 -1.133901
C 1.184434 3.412268 -1.044124
C 2.849772 -1.885569 1.370827
C 0.065219 3.625621 1.088035
C 3.066046 -1.841361 -1.036533
C 0.774995 4.205064 0.033497
C 3.562188 -2.218368 0.214775
H -1.022820 0.484327 -2.084941
H -0.611502 -1.255394 -1.906081
H -2.829672 -2.508645 -1.750273
H -4.005999 -1.196551 -2.077095
H -5.053758 -1.460951 0.095587
H -4.147065 -3.033731 0.225071
H 1.219366 1.441718 -1.904808
H 1.094073 -0.922901 2.186442
H -0.789543 1.819089 1.903543
H 1.499270 -0.846301 -2.116871
H 1.745029 3.857071 -1.863929
H 3.233392 -2.171987 2.348794
H -0.250808 4.235534 1.932738
H 3.620364 -2.091495 -1.938942
H 1.011863 5.266565 0.051140
H 4.499771 -2.764999 0.288958


%chk=000288592-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000288592

0 1
O -3.282936 -1.349532 1.143258
N -2.290884 -0.665793 -0.828531
N -0.960959 -0.615622 1.097918
C -0.090299 -0.183486 -0.075273
C -0.925516 -0.586849 -1.383877
C -2.123643 -0.850955 0.560399
C -3.424237 -1.486566 -1.285712
C 0.127063 1.354933 -0.025452
C 1.266361 -0.905785 0.000275
C -4.275401 -1.509085 0.020307
C 0.833938 2.013929 -1.064470
C 1.800729 -1.253103 1.266378
C -0.360126 2.123166 1.058862
C 2.023000 -1.194711 -1.163458
C 1.034738 3.410533 -1.029239
C 3.067126 -1.869032 1.365339
C -0.157632 3.522046 1.097029
C 3.290660 -1.812022 -1.065146
C 0.537299 4.173156 0.053445
C 3.820028 -2.148983 0.200890
H -0.843310 0.169806 -2.179561
H -0.600002 -1.577034 -1.770436
H -3.104475 -2.508803 -1.587710
H -3.977312 -1.022524 -2.119161
H -4.972838 -0.655698 0.069412
H -4.805724 -2.456899 0.192715
H 1.250231 1.437897 -1.899808
H 1.199573 -1.051291 2.157505
H -0.890992 1.611310 1.866993
H 1.631567 -0.947347 -2.158095
H 1.584259 3.901850 -1.840538
H 3.465658 -2.134667 2.351210
H -0.542207 4.101852 1.944078
H 3.861995 -2.029194 -1.975018
H 0.694136 5.257374 0.083754
H 4.803032 -2.627075 0.278916


