%chk=000225247.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225247

0 1
O -7.416119 2.691903 0.186242
O 7.416185 -2.699206 -0.185786
O -9.736796 -1.284809 0.595320
O 9.737818 1.277021 -0.594135
N -4.976873 0.980213 -0.649213
N 4.977318 -0.987075 0.649880
N -5.128808 -1.304449 -0.755766
N 5.129814 1.297530 0.756885
N -7.537179 -1.452470 -0.059274
N 7.538251 1.445091 0.060523
N -8.578768 0.710658 0.391377
N 8.579364 -0.718216 -0.390364
C -0.471991 -0.124591 -0.592020
C 0.472731 0.118501 0.592718
C -1.939677 -0.025986 -0.158423
C 1.940410 0.020133 0.159073
C -2.884072 -0.278295 -1.343903
C 2.884793 0.271813 1.344687
C -4.309283 -0.213513 -0.923071
C 4.310009 0.206769 0.923935
C -6.291283 0.636940 -0.284336
C 6.291837 -0.644058 0.285161
C -6.357395 -0.780489 -0.360221
C 6.358295 0.773340 0.361313
C -7.398427 1.481094 0.097629
C 7.398806 -1.488416 -0.096867
C -8.698579 -0.710267 0.329951
C 8.699494 0.702674 -0.328762
C -7.600746 -2.931545 -0.144341
C 7.602181 2.924132 0.145885
C -9.812462 1.438217 0.800692
C 9.813059 -1.446040 -0.799209
H -0.262965 0.607335 -1.396931
H -0.274903 -1.122080 -1.032850
H 0.263805 -0.613534 1.397557
H 0.275541 1.115919 1.033658
H -2.138709 0.968008 0.286385
H -2.149571 -0.764096 0.643762
H 2.139466 -0.973601 -0.286303
H 2.150310 0.758686 -0.642707
H -2.685208 0.440737 -2.166645
H -2.682552 -1.287477 -1.779061
H 2.683505 1.280923 1.780128
H 2.685670 -0.447406 2.167206
H -4.632667 1.924196 -0.684555
H 4.632872 -1.930977 0.685041
H -8.613007 -3.285596 0.131114
H -6.863094 -3.385405 0.541272
H -7.371720 -3.265343 -1.172202
H 7.373699 3.257763 1.173919
H 6.864313 3.378299 -0.539294
H 8.614395 3.278021 -0.129955
H -9.619740 2.527799 0.816493
H -10.132449 1.116794 1.806976
H -10.634003 1.230516 0.093341
H 10.632438 -1.243896 -0.087778
H 10.137343 -1.119761 -1.802568
H 9.618221 -2.535130 -0.821584


%chk=000225247-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000225247

0 1
O -8.152686 2.796927 -0.452481
O 8.141767 -2.813370 0.436260
O -9.520489 -1.546965 0.804220
O 9.525911 1.529705 -0.805220
N -5.330881 1.537820 -0.799064
N 5.326846 -1.542874 0.796720
N -4.936018 -0.664234 -0.403765
N 4.941016 0.662794 0.412723
N -7.260985 -1.251672 0.240379
N 7.266751 1.242370 -0.235858
N -8.819362 0.600667 0.176495
N 8.816693 -0.617433 -0.185000
C -0.489897 0.279143 -0.525132
C 0.490695 -0.275563 0.532428
C -1.965586 0.168953 -0.085870
C 1.966301 -0.167428 0.092345
C -2.941576 0.722881 -1.157047
C 2.942352 -0.718535 1.165089
C -4.382539 0.523402 -0.787494
C 4.383270 -0.523990 0.792951
C -6.554625 0.983407 -0.409051
C 6.551942 -0.992361 0.405455
C -6.274415 -0.369973 -0.172549
C 6.277303 0.363387 0.175984
C -7.852419 1.579394 -0.252031
C 7.846490 -1.593617 0.241969
C -8.585827 -0.783208 0.429567
C 8.588797 0.768584 -0.431326
C -6.946590 -2.672437 0.483542
C 6.958205 2.665634 -0.471786
C -10.213668 1.055364 0.383129
C 10.208297 -1.077625 -0.397613
H -0.239571 1.340192 -0.733785
H -0.348235 -0.269170 -1.479809
H 0.239442 -1.336166 0.742228
H 0.350051 0.273794 1.486645
H -2.115891 0.716668 0.865740
H -2.228288 -0.887094 0.112043
H 2.115954 -0.718179 -0.857617
H 2.229480 0.887904 -0.108826
H -2.746516 1.799558 -1.327563
H -2.741409 0.207614 -2.117892
H 2.744534 -0.198144 2.123570
H 2.745025 -1.793948 1.340837
H -5.188856 2.517263 -1.045660
H 5.181067 -2.522734 1.039433
H -7.871359 -3.164300 0.818132
H -6.165868 -2.759271 1.257581
H -6.578874 -3.143960 -0.443320
H 6.593727 3.134210 0.457833
H 6.176869 2.759662 -1.244383
H 7.884638 3.155086 -0.805309
H -10.242652 2.131929 0.159627
H -10.522825 0.866817 1.424085
H -10.894985 0.503105 -0.284518
H 10.894155 -0.530747 0.269806
H 10.515081 -0.886850 -1.438873
H 10.233130 -2.155089 -0.177974


