%chk=000189688.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189688

0 1
O 4.068899 0.902559 0.443739
O -5.347722 -0.175448 -0.359063
O 4.281988 3.450885 0.190047
N -0.453755 -0.853474 0.193896
C 0.576210 0.105943 0.185983
C -0.017369 1.422388 -0.004454
C -1.453959 1.219387 -0.120733
C 1.947947 -0.084809 0.339498
C -1.693100 -0.192172 -0.003066
C 2.563035 -1.434654 0.564571
C 0.788246 2.536939 -0.043068
C 2.742535 1.088255 0.292309
C 2.187662 2.387486 0.103912
C -2.531930 2.084763 -0.310093
C -2.972073 -0.748266 -0.072577
C -4.019027 0.163451 -0.263583
C -3.818742 1.560375 -0.382222
C 2.129587 -2.439608 -0.460220
C 1.665046 -3.669067 -0.190427
C 3.060743 3.550023 0.063793
C 1.287392 -4.616807 -1.288953
C 1.496376 -4.213853 1.193880
C -5.706380 -1.574587 -0.253064
H -0.311574 -1.850388 0.246974
H 3.677437 -1.351479 0.532184
H 2.328797 -1.773910 1.599256
H 0.359953 3.529273 -0.185100
H -2.367097 3.157674 -0.400328
H -3.132830 -1.812782 0.017323
H -4.684080 2.202509 -0.528972
H 2.240721 -2.093099 -1.489077
H 2.603363 4.539032 -0.084164
H 4.608600 1.803001 0.394473
H 1.428768 -4.186798 -2.289171
H 1.897305 -5.530328 -1.245167
H 0.236798 -4.924427 -1.213031
H 1.574476 -3.433234 1.965597
H 0.529553 -4.714420 1.325022
H 2.277101 -4.956870 1.414007
H -5.252411 -2.145507 -1.067911
H -6.798419 -1.533746 -0.362002
H -5.424970 -1.965309 0.728879


%chk=000189688-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000189688

0 1
O 4.157668 0.970973 0.412960
O -5.393508 -0.222144 -0.387362
O 4.390762 3.507952 0.256641
N -0.432587 -0.764209 0.104867
C 0.589869 0.186154 0.131488
C -0.013741 1.498707 -0.001106
C -1.455864 1.290185 -0.113597
C 1.977528 -0.039319 0.277355
C -1.679195 -0.123832 -0.051304
C 2.587621 -1.421217 0.477671
C 0.814527 2.624369 0.002083
C 2.791420 1.120436 0.273007
C 2.223675 2.452047 0.133698
C -2.570289 2.149086 -0.263307
C -2.962007 -0.702204 -0.136741
C -4.054031 0.188248 -0.287956
C -3.861165 1.599141 -0.349720
C 2.037436 -2.489245 -0.453836
C 1.595569 -3.741636 -0.127938
C 3.107813 3.597405 0.137601
C 1.149016 -4.712890 -1.210870
C 1.546316 -4.301866 1.284696
C -5.669879 -1.658079 -0.332208
H -0.253443 -1.769862 0.083912
H 3.678303 -1.320398 0.319271
H 2.465929 -1.725688 1.535846
H 0.405001 3.637009 -0.094921
H -2.439416 3.235306 -0.313347
H -3.100545 -1.785499 -0.085603
H -4.745261 2.232311 -0.465766
H 2.047324 -2.212230 -1.519607
H 2.646646 4.602361 0.030756
H 4.578063 1.919052 0.381900
H 1.198810 -4.260026 -2.216106
H 1.787627 -5.618665 -1.213445
H 0.111458 -5.062714 -1.037780
H 1.744604 -3.546607 2.062674
H 0.559532 -4.760608 1.492856
H 2.297107 -5.108133 1.404659
H -5.180424 -2.194998 -1.168644
H -6.762184 -1.745049 -0.426025
H -5.342985 -2.094724 0.632142


