%chk=000219598.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219598

0 1
O 0.757971 2.281429 -1.396731
O -0.785168 2.264106 1.412988
O 1.969030 -2.024926 -1.880767
O -1.936479 -2.067218 1.859468
O 0.349977 -0.609892 -1.620114
O -0.340228 -0.623810 1.614423
O 5.646993 -0.592497 2.959284
O -5.642338 -0.637882 -2.959788
O 5.397962 -2.250111 1.584223
O -5.369213 -2.304446 -1.600203
N 1.450494 -1.070664 -1.343668
N -1.433227 -1.099111 1.332698
N 5.093255 -1.164909 2.039697
N -5.079687 -1.211180 -2.046185
C 1.781132 0.854922 0.236341
C -1.792075 0.836213 -0.229046
C 2.187421 -0.405852 -0.239590
C -2.180609 -0.434284 0.235725
C 0.652654 1.621338 -0.400488
C -0.672381 1.611415 0.412701
C 2.450307 1.437822 1.316535
C -2.471038 1.420238 -1.302497
C 3.272906 -1.075648 0.338368
C -3.257868 -1.113291 -0.346894
C 3.936368 -0.467300 1.411411
C -3.931320 -0.503896 -1.413091
C 3.530298 0.778156 1.912248
C -3.543068 0.751681 -1.902674
H 2.122978 2.408074 1.708308
H -2.157721 2.398574 -1.685482
H 3.598359 -2.060639 -0.039856
H -3.569263 -2.106161 0.022488
H 4.060837 1.224474 2.766042
H -4.081156 1.198878 -2.751272


%chk=000219598-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000219598

0 1
O 0.675068 1.907756 -1.456087
O -0.699008 1.891660 1.470872
O 2.151881 -2.630820 -1.209942
O -2.113701 -2.668791 1.183307
O 0.507416 -1.056459 -1.326677
O -0.496922 -1.067898 1.324076
O 6.115578 0.090871 2.940303
O -6.116833 0.038714 -2.938453
O 5.912923 -1.905110 1.849353
O -5.885869 -1.964998 -1.867484
N 1.652974 -1.494214 -0.895449
N -1.633400 -1.520242 0.883738
N 5.513109 -0.715421 2.136171
N -5.502793 -0.767077 -2.142637
C 1.898038 0.692806 0.270740
C -1.907566 0.673031 -0.263316
C 2.401670 -0.606295 0.021091
C -2.393323 -0.635106 -0.026051
C 0.649916 1.218016 -0.403912
C -0.665553 1.207954 0.414966
C 2.612843 1.526671 1.162067
C -2.634175 1.505736 -1.146089
C 3.582548 -1.092286 0.607846
C -3.567234 -1.131830 -0.617772
C 4.259168 -0.231601 1.488748
C -4.255744 -0.272084 -1.490341
C 3.793952 1.068740 1.780332
C -3.808864 1.037529 -1.768896
H 2.236193 2.530061 1.376467
H -2.271603 2.516364 -1.350584
H 3.954311 -2.097680 0.393429
H -3.925171 -2.144214 -0.412941
H 4.356108 1.696017 2.477047
H -4.379835 1.663804 -2.459322


