%chk=000259096.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259096

0 1
O 6.900796 -0.177274 0.256035
O -6.898834 0.178123 0.255623
O 0.831184 1.778778 0.133739
O -0.829497 -1.779549 0.140908
N 0.704063 -0.021432 -1.276990
N -0.702324 0.014980 -1.277065
C 2.841641 0.494687 -0.200665
C -2.839850 -0.496551 -0.198539
C 3.795712 1.506204 -0.433084
C -3.794187 -1.508582 -0.427567
C 3.249459 -0.778180 0.218334
C -3.247325 0.777866 0.216075
C 1.402558 0.822832 -0.355867
C -1.400825 -0.825547 -0.352502
C 5.540910 -0.052378 0.139069
C -5.538979 0.052444 0.139160
C 5.147380 1.241041 -0.274261
C -5.145792 -1.242490 -0.269735
C 4.604301 -1.065787 0.391756
C -4.602095 1.066446 0.388436
C 7.436860 -1.454101 0.685912
C -7.434563 1.456558 0.681120
H 3.460342 2.501523 -0.736747
H -3.459091 -2.505027 -0.727815
H 2.506570 -1.553113 0.426867
H -2.504212 1.553294 0.421970
H 5.906570 2.000322 -0.451996
H -5.905191 -2.002151 -0.444934
H 4.909992 -2.053469 0.720715
H -4.907527 2.055333 0.713998
H 1.066749 -0.963382 -1.482388
H -1.064999 0.956120 -1.486174
H 7.185990 -2.234405 -0.038153
H 7.081188 -1.695974 1.691621
H 8.516532 -1.251734 0.688637
H -7.078856 1.701770 1.686007
H -8.514290 1.254495 0.684501
H -7.183456 2.234312 -0.045602


%chk=000259096-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000259096

0 1
O 7.226498 -0.155490 0.004829
O -7.224556 0.154754 0.004938
O 1.167035 2.071955 0.001257
O -1.165094 -2.072694 0.008787
N 0.678441 -0.168571 0.005322
N -0.676498 0.167830 0.004769
C 3.043990 0.502940 0.003891
C -3.042048 -0.503679 0.006137
C 3.981659 1.572778 0.001732
C -3.979718 -1.573517 0.008000
C 3.532645 -0.828311 0.006429
C -3.530702 0.827574 0.003907
C 1.598515 0.863797 0.003319
C -1.596573 -0.864537 0.006611
C 5.836083 -0.014692 0.004702
C -5.834140 0.013955 0.005311
C 5.360569 1.322857 0.002135
C -5.358628 -1.323595 0.007619
C 4.916955 -1.095904 0.006836
C -4.915012 1.095167 0.003480
C 7.779050 -1.514448 0.008686
C -7.777107 1.513716 0.003438
H 3.592781 2.595853 -0.000214
H -3.590841 -2.596593 0.009753
H 2.849602 -1.685906 0.008149
H -2.847658 1.685168 0.002442
H 6.089947 2.138065 0.000556
H -6.088007 -2.138802 0.009078
H 5.263545 -2.133141 0.008793
H -5.261602 2.132405 0.001750
H 0.831741 -1.181998 0.007001
H -0.829797 1.181257 0.002850
H 7.472374 -2.074482 -0.895588
H 7.471063 -2.069873 0.915348
H 8.870091 -1.378698 0.009108
H -7.469422 2.072601 0.908076
H -8.868148 1.377969 0.004027
H -7.470128 2.070291 -0.902865


