%chk=000195970.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000195970

0 1
O -0.180473 0.331403 2.298506
O -6.297038 -0.945059 -1.849787
O -6.305734 -1.814816 0.129921
N 2.159711 1.812105 2.550470
N -0.632447 1.039452 0.148963
N 5.086507 -0.431718 -0.352533
N -5.785121 -1.161783 -0.761134
N 7.030749 -0.789917 -1.798188
N 6.553956 -2.238945 0.054346
C 2.470205 0.878358 0.260266
C 1.546119 1.661178 1.213263
C 3.796386 1.611976 0.030322
C 4.707405 0.857340 -0.955789
C 0.181745 0.928482 1.308705
C -1.920379 0.469217 -0.033181
C -2.559873 0.693535 -1.278576
C -2.560923 -0.291756 0.966979
C -3.820039 0.160925 -1.511537
C -3.821460 -0.822244 0.727940
C -4.452514 -0.598205 -0.509932
C 6.133690 -1.106634 -0.734622
H 1.965889 0.697210 -0.706475
H 2.689331 -0.131860 0.674271
H 1.374736 2.700182 0.817888
H 4.324042 1.735752 1.001913
H 3.616636 2.635515 -0.347463
H 4.175011 0.685397 -1.917913
H 5.592258 1.495652 -1.185803
H 1.471146 2.106543 3.240956
H 2.553993 0.931738 2.877507
H -0.260835 1.562680 -0.649711
H -2.074435 1.280716 -2.055583
H -2.066347 -0.465323 1.932187
H -4.331152 0.323730 -2.468078
H -4.333231 -1.416362 1.495345
H 6.620224 -0.460758 -2.657950
H 7.816220 -1.409002 -1.944805
H 6.477611 -3.127088 -0.429767
H 6.071132 -2.294916 0.951883


%chk=000195970-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000195970

0 1
O 0.023400 0.009917 2.207678
O -6.499242 -0.701158 -1.815582
O -6.321689 -2.037257 0.027313
N 2.229351 1.841493 2.398602
N -0.713625 1.085993 0.249976
N 5.108993 -0.455558 -0.229066
N -5.859234 -1.136207 -0.777453
N 6.954734 -1.001648 -1.716217
N 6.593762 -2.209412 0.263513
C 2.485865 0.853125 0.137713
C 1.552905 1.623928 1.116739
C 3.780082 1.621992 -0.192282
C 4.767560 0.754652 -1.003691
C 0.223970 0.826961 1.265554
C -1.983935 0.504206 0.037630
C -2.734236 0.948924 -1.090694
C -2.529497 -0.492170 0.898823
C -4.001930 0.416453 -1.362749
C -3.800035 -1.025763 0.626236
C -4.526440 -0.571299 -0.497423
C 6.156697 -1.168063 -0.571314
H 1.935035 0.622904 -0.797965
H 2.768866 -0.117174 0.589266
H 1.321836 2.618447 0.675529
H 4.258739 1.931893 0.753046
H 3.545238 2.542949 -0.766191
H 4.290213 0.483012 -1.976225
H 5.666069 1.372897 -1.247162
H 1.675622 2.388358 3.067925
H 2.535802 0.957215 2.822603
H -0.429099 1.788408 -0.438927
H -2.316918 1.715703 -1.754954
H -1.949981 -0.826608 1.760404
H -4.590723 0.744743 -2.222874
H -4.239882 -1.791011 1.271136
H 6.668676 -0.338428 -2.430151
H 7.919806 -1.324265 -1.721427
H 6.980009 -3.055324 -0.153678
H 6.065939 -2.310129 1.129145


