%chk=000257836.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257836

0 1
O 6.972701 1.049841 0.558106
O 6.966571 -1.112332 0.557032
N 6.421401 -0.029617 0.407931
N -7.980113 0.010645 -0.404172
C -0.040567 -0.010771 0.138543
C -1.524724 -0.006745 -0.244519
C 0.857072 -0.013079 -1.110055
C -2.424913 -0.003690 1.001454
C 2.307229 -0.017392 -0.718596
C -3.877261 0.000060 0.611203
C 2.991725 1.196783 -0.529234
C 2.984821 -1.235615 -0.530419
C -4.559196 1.212225 0.422815
C -4.565593 -1.208583 0.423400
C 4.334634 1.199069 -0.161400
C 4.327696 -1.245882 -0.162592
C -5.902664 1.226641 0.054438
C -5.909112 -1.216081 0.055028
C 4.999081 -0.025392 0.019934
C -6.589065 0.007044 -0.126130
H 0.193151 0.872026 0.765993
H 0.188366 -0.894939 0.765831
H -1.762531 -0.888716 -0.870961
H -1.757585 0.876004 -0.871710
H 0.619606 -0.892753 -1.744103
H 0.624743 0.868284 -1.743663
H -2.198724 -0.884159 1.636540
H -2.193936 0.876146 1.635682
H 2.468569 2.142919 -0.669065
H 2.456306 -2.178632 -0.671167
H -4.034241 2.156376 0.565675
H -4.045624 -2.155418 0.566723
H 4.878214 2.138517 -0.012065
H 4.865933 -2.188546 -0.014176
H -6.420369 2.172608 -0.076310
H -6.431816 -2.159358 -0.075265
H -8.347597 -0.824559 -0.836666
H -8.343189 0.847571 -0.837062


%chk=000257836-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000257836

0 1
O 7.091157 1.104013 0.615972
O 7.082361 -1.177060 0.612330
N 6.501928 -0.033996 0.444568
N -8.040765 0.006646 -0.545129
C -0.024462 -0.008009 0.123450
C -1.522822 -0.003654 -0.248595
C 0.899435 -0.010032 -1.130238
C -2.451937 -0.000722 0.997765
C 2.370476 -0.016103 -0.757456
C -3.928547 0.001363 0.630282
C 3.074096 1.202204 -0.552668
C 3.064687 -1.240448 -0.556561
C -4.636359 1.213994 0.426585
C -4.640545 -1.209428 0.430279
C 4.425160 1.209083 -0.158635
C 4.415635 -1.259094 -0.162556
C -5.990892 1.227013 0.038520
C -5.995121 -1.218957 0.042284
C 5.080458 -0.027856 0.033234
C -6.695707 0.004928 -0.162649
H 0.210202 0.878430 0.746948
H 0.205122 -0.896417 0.746033
H -1.758194 -0.890141 -0.871813
H -1.753107 0.883835 -0.872288
H 0.656791 -0.898488 -1.744603
H 0.663385 0.881577 -1.742582
H -2.213675 -0.889073 1.616258
H -2.210653 0.888061 1.614472
H 2.554486 2.154433 -0.709845
H 2.537721 -2.188123 -0.716777
H -4.119059 2.170068 0.580624
H -4.126514 -2.166786 0.587252
H 4.978576 2.138703 -0.001436
H 4.961821 -2.193474 -0.008314
H -6.511341 2.182559 -0.104525
H -6.518882 -2.173135 -0.097769
H -8.544460 -0.864394 -0.681312
H -8.541454 0.878978 -0.684104


