%chk=000278621.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000278621

0 1
O -1.824134 -0.852227 -0.453989
O 1.824033 -0.852527 0.454288
O -1.530754 1.029397 0.782062
O 1.530256 1.030353 -0.779704
O -8.487512 1.755955 0.318922
O 8.487504 1.754991 -0.320437
O -8.599221 -0.139569 -0.719711
O 8.599477 -0.141536 0.716335
N -7.985557 0.757749 -0.167870
N 7.985650 0.756434 0.165736
C -0.393676 -1.111882 -0.664132
C 0.393559 -1.111809 0.664945
C -0.399716 -2.556083 -1.177993
C 0.399499 -2.555852 1.179266
C -0.001714 -3.463951 0.001264
C -2.265491 0.272489 0.193869
C 2.265256 0.272733 -0.192758
C -3.752256 0.366525 0.081031
C 3.752104 0.366351 -0.080798
C -4.376631 1.497958 0.629080
C 4.376370 1.498163 -0.628190
C -4.503716 -0.635416 -0.548863
C 4.503756 -0.636340 0.547671
C -5.763723 1.630617 0.548889
C 5.763541 1.630449 -0.548770
C -5.891699 -0.510631 -0.632159
C 5.891819 -0.511932 0.630188
C -6.506143 0.622326 -0.081198
C 6.506151 0.621409 0.079892
H -0.044813 -0.347623 -1.389494
H 0.044952 -0.347270 1.390139
H -1.401077 -2.820841 -1.570393
H 0.303144 -2.664459 -2.023339
H 1.401565 -2.821181 1.569538
H -0.301491 -2.663453 2.026248
H 0.832970 -4.127937 -0.284105
H -0.838900 -4.124392 0.287595
H -3.770937 2.270761 1.116476
H 3.770528 2.271553 -1.114471
H -3.998134 -1.509230 -0.972753
H 3.998260 -1.510444 0.971067
H -6.272119 2.506284 0.969397
H 6.271854 2.506400 -0.968786
H -6.499519 -1.281461 -1.119794
H 6.499787 -1.283349 1.116708


%chk=000278621-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000278621

0 1
O -1.809048 -0.870457 -0.450404
O 1.808818 -0.870610 0.449671
O -1.780934 1.287262 -1.357495
O 1.780892 1.286784 1.357553
O -8.673644 1.669908 0.093553
O 8.673945 1.668830 -0.092016
O -8.607487 -0.454883 0.920973
O 8.607590 -0.455622 -0.920281
N -8.051058 0.577992 0.383670
N 8.051223 0.577143 -0.382705
C -0.337143 -1.014582 -0.697277
C 0.336893 -1.014695 0.696490
C -0.082011 -2.427231 -1.247103
C 0.081608 -2.427355 1.246400
C -0.001832 -3.368595 -0.000338
C -2.403739 0.343506 -0.817707
C 2.403602 0.343192 0.817370
C -3.864375 0.363332 -0.493177
C 3.864307 0.362888 0.493141
C -4.591142 1.544413 -0.795452
C 4.591221 1.543718 0.796048
C -4.520177 -0.747376 0.098709
C 4.520038 -0.747702 -0.099043
C -5.966098 1.623120 -0.510266
C 5.966253 1.622291 0.511191
C -5.895824 -0.682196 0.388631
C 5.895760 -0.682652 -0.388643
C -6.595591 0.504443 0.078565
C 6.595673 0.503737 -0.077951
H -0.008363 -0.183490 -1.342402
H 0.008196 -0.183610 1.341669
H -0.866921 -2.721511 -1.963323
H 0.880056 -2.416749 -1.789738
H 0.867810 -2.722326 1.960920
H -0.879269 -2.416325 1.791104
H 0.882793 -4.024502 -0.065474
H -0.888957 -4.021118 0.064835
H -4.059912 2.385653 -1.251013
H 4.060044 2.384868 1.251834
H -3.946601 -1.649617 0.323877
H 3.946352 -1.649754 -0.324686
H -6.552754 2.518434 -0.730211
H 6.553023 2.517410 0.731627
H -6.431334 -1.519047 0.843776
H 6.431218 -1.519418 -0.844003


