%chk=000276419.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000276419

0 1
O 2.593822 -1.454077 0.206091
O -4.173050 2.385637 0.352641
N -4.983545 0.252946 0.412502
C 0.745829 -0.044506 -0.166039
C -0.613610 0.206820 -0.387540
C -1.478159 -0.912414 -0.441647
C 1.198597 -1.385745 -0.006658
C 1.935221 0.786093 -0.043802
C 0.363323 -2.501041 -0.054985
C -2.954046 -0.722986 -0.669544
C -0.993313 -2.221629 -0.276544
C 3.022540 -0.113579 0.179331
C -1.108594 1.598844 -0.573252
C -3.650799 -0.346559 0.653030
C 2.200902 2.151146 -0.094283
C 0.877111 -3.887467 0.116643
C 4.339372 0.291309 0.348970
C 3.523044 2.582155 0.074879
C 4.569065 1.671827 0.291258
C -5.128045 1.631259 0.253823
H -3.411161 -1.633760 -1.101374
H -3.121822 0.070641 -1.429295
H -1.693410 -3.055959 -0.322539
H -0.393160 2.353796 -0.216378
H -1.302483 1.812253 -1.634440
H -2.058206 1.793799 -0.035449
H -3.762167 -1.238013 1.305320
H -3.022671 0.391753 1.214142
H 1.391866 2.863470 -0.259989
H 1.965828 -3.900813 0.282007
H 0.412411 -4.385184 0.979175
H 0.677056 -4.503189 -0.771486
H 5.139646 -0.422163 0.516372
H 3.744769 3.647369 0.038009
H 5.585028 2.045753 0.418026
H -5.750601 -0.385312 0.244842
H -6.158088 1.970127 0.061282


%chk=000276419-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000276419

0 1
O 2.622496 -1.479314 0.176185
O -4.622295 2.294804 -0.232540
N -5.098892 0.139404 0.531627
C 0.793204 -0.037461 -0.156156
C -0.582375 0.264757 -0.354946
C -1.483466 -0.840764 -0.416986
C 1.214802 -1.391105 -0.016887
C 2.009023 0.775772 -0.049455
C 0.359438 -2.501590 -0.066239
C -2.980361 -0.631131 -0.608453
C -1.002508 -2.174977 -0.274245
C 3.085721 -0.140907 0.151725
C -1.023403 1.711831 -0.495373
C -3.683725 -0.233737 0.722071
C 2.312034 2.159456 -0.104644
C 0.858202 -3.925419 0.081700
C 4.424582 0.239029 0.301726
C 3.655674 2.570407 0.043530
C 4.698520 1.625959 0.244566
C -5.452623 1.385318 0.059674
H -3.444578 -1.556635 -0.997356
H -3.180335 0.165775 -1.346223
H -1.727464 -2.997691 -0.334432
H -0.693208 2.306724 0.377790
H -0.563255 2.174951 -1.390183
H -2.114442 1.835859 -0.578660
H -3.628183 -1.063580 1.448923
H -3.163459 0.635966 1.159989
H 1.526927 2.903648 -0.262012
H 1.947817 -3.949261 0.242003
H 0.375570 -4.430734 0.938824
H 0.632945 -4.522780 -0.821282
H 5.213028 -0.503219 0.453396
H 3.899835 3.637361 0.001922
H 5.730861 1.974776 0.355743
H -5.833144 -0.547009 0.713900
H -6.554466 1.518118 -0.036124


