%chk=000278371.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000278371

0 1
O 2.449360 -0.349264 -1.206771
O 2.158892 0.806703 0.712552
N 0.213289 -2.796522 -1.287296
C -0.675577 1.652646 0.760226
C -2.217930 -0.226317 -0.081519
C -0.798193 0.291976 0.090440
C -1.279566 2.750119 -0.141920
C -2.579370 -0.591064 -1.536944
C -1.325070 1.612032 2.148184
C -2.451582 -1.422108 0.850427
C 0.300238 -0.410121 -0.295304
C -0.876371 4.149901 0.312047
C -2.383406 0.561497 -2.514434
C 1.693484 0.098260 -0.153309
C 0.240326 -1.722823 -0.855393
C 3.880738 -0.032464 -1.208938
C 4.608105 -0.961298 -0.261111
H 0.410654 1.909890 0.923153
H -2.926966 0.589285 0.230794
H -2.383760 2.666340 -0.160770
H -0.941215 2.593893 -1.186718
H -3.639190 -0.920184 -1.559107
H -2.003443 -1.472651 -1.879977
H -0.886762 0.820110 2.768066
H -1.159340 2.560406 2.675753
H -2.407439 1.450564 2.104801
H -2.152208 -1.198177 1.880901
H -3.511270 -1.703250 0.870532
H -1.892555 -2.312806 0.535835
H 0.213626 4.274989 0.323913
H -1.285932 4.914970 -0.357729
H -1.239629 4.370762 1.322619
H -2.676745 0.264615 -3.529770
H -1.333434 0.875453 -2.567125
H -2.985849 1.436243 -2.246842
H 4.123499 -0.213450 -2.272615
H 4.006888 1.032848 -0.947800
H 5.695627 -0.876378 -0.369860
H 4.361413 -0.737434 0.787364
H 4.335660 -2.010891 -0.439854


%chk=000278371-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000278371

0 1
O 2.576768 -0.826022 -1.064295
O 2.110905 1.319693 -0.296688
N 0.038561 -2.730306 -1.718377
C -0.620255 1.626175 0.731552
C -2.215339 -0.247785 -0.118617
C -0.784556 0.313037 -0.038288
C -1.228534 2.817305 -0.082854
C -2.741071 -0.567337 -1.554385
C -1.221526 1.524088 2.161454
C -2.386190 -1.489234 0.809394
C 0.301529 -0.352740 -0.599152
C -0.900912 4.195614 0.530496
C -2.686528 0.612811 -2.546980
C 1.711763 0.167729 -0.608333
C 0.151739 -1.647567 -1.221682
C 4.025918 -0.470288 -1.161902
C 4.732903 -0.713765 0.174178
H 0.454318 1.845109 0.832570
H -2.877658 0.545591 0.279363
H -2.327091 2.697048 -0.168019
H -0.821980 2.780582 -1.111598
H -3.794506 -0.891325 -1.432465
H -2.202055 -1.432523 -1.975874
H -0.771758 0.685907 2.723637
H -1.001269 2.450775 2.719162
H -2.318555 1.389102 2.157594
H -2.096414 -1.262164 1.850050
H -3.445537 -1.805714 0.809117
H -1.778529 -2.339959 0.456977
H 0.191233 4.324326 0.645364
H -1.269397 5.005836 -0.125057
H -1.369000 4.333915 1.521581
H -3.127009 0.319471 -3.517100
H -1.646639 0.934709 -2.738239
H -3.250147 1.487612 -2.171979
H 4.397174 -1.138426 -1.954875
H 4.108684 0.584767 -1.477036
H 5.818683 -0.540533 0.055748
H 4.357187 -0.025720 0.949828
H 4.584086 -1.753495 0.512234


