%chk=000257231.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257231

0 1
O 0.352923 1.987166 0.399238
O 2.843525 0.124448 -0.930841
O 2.982470 0.651662 1.272227
N 0.843005 -2.524649 -1.059401
C -1.490704 -0.008058 -0.397501
C -0.027852 -0.200840 -0.321171
C 0.843725 0.752934 0.106846
C -2.355678 -1.073022 -0.085044
C -2.026890 1.231857 -0.781463
C 1.163639 2.875602 1.260875
C 2.327617 0.510171 0.266210
C -3.737656 -0.892960 -0.157557
C -3.412163 1.402640 -0.853233
C -4.269097 0.343373 -0.542544
C 4.253109 -0.299696 -0.978150
C 0.197513 3.998829 1.562789
C 4.359030 -1.722077 -0.480707
C 0.462533 -1.482986 -0.729750
H -1.951471 -2.038811 0.217462
H -1.360216 2.063000 -1.020116
H 1.477265 2.310949 2.157838
H 2.041512 3.195278 0.675248
H -4.404374 -1.719115 0.086015
H -3.822709 2.365366 -1.153507
H 4.450940 -0.195114 -2.061641
H 4.855551 0.414352 -0.390778
H -5.347553 0.478099 -0.599979
H 0.646728 4.735219 2.241236
H -0.114228 4.524860 0.649833
H -0.720625 3.620372 2.037243
H 5.345139 -2.151887 -0.695188
H 4.198555 -1.790017 0.604678
H 3.607439 -2.374245 -0.955468


%chk=000257231-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000257231

0 1
O 0.367959 1.997678 0.724600
O 2.809378 -0.031830 -0.872337
O 3.030206 0.864177 1.272967
N 0.817092 -2.495189 -1.069706
C -1.554733 -0.014913 -0.338631
C -0.070669 -0.139473 -0.279854
C 0.837779 0.809802 0.192067
C -2.310948 -1.078562 -0.921477
C -2.271417 1.118139 0.154423
C 1.292734 3.157017 0.950852
C 2.322084 0.550984 0.280690
C -3.714150 -1.010880 -1.016114
C -3.676943 1.177098 0.057637
C -4.409444 0.119075 -0.526924
C 4.232953 -0.511790 -0.849408
C 0.402297 4.353357 1.267092
C 4.321115 -1.892633 -0.194368
C 0.458701 -1.410003 -0.713919
H -1.794257 -1.964383 -1.305351
H -1.724028 1.939609 0.614721
H 1.971353 2.901949 1.780641
H 1.886228 3.317548 0.030331
H -4.264409 -1.842047 -1.470462
H -4.203351 2.056463 0.445884
H 4.499814 -0.537677 -1.917102
H 4.843454 0.238547 -0.316338
H -5.501469 0.172076 -0.597565
H 1.034065 5.239227 1.461210
H -0.273488 4.584805 0.426129
H -0.205219 4.161159 2.168074
H 5.351812 -2.280371 -0.295206
H 4.078764 -1.836687 0.880201
H 3.627739 -2.599570 -0.679061


