%chk=000257870.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257870

0 1
O 0.161820 2.508454 -0.892259
N -4.007232 -0.797870 -2.233804
N 4.779230 0.992573 0.956825
N -3.292536 -0.466774 2.568798
N 2.449893 -2.998474 -0.594474
C -1.232669 0.677976 -0.282242
C 1.318986 0.514984 -0.281832
C 0.093577 1.356282 -0.528203
C -1.644095 0.459713 1.030448
C 1.280955 -0.858783 -0.516281
C -2.005874 0.298977 -1.377355
C 2.472952 1.150570 0.175290
C -3.249005 -0.333566 -1.141276
C 3.631325 0.376286 0.414537
C -2.891676 -0.169887 1.252071
C 2.447953 -1.622515 -0.283681
C -3.705489 -0.558801 0.171127
C 3.626195 -1.012232 0.186534
H -1.015130 0.753037 1.863912
H 0.372471 -1.334486 -0.877292
H -1.661916 0.488205 -2.388531
H 2.473373 2.225803 0.336732
H -4.653664 -1.052169 0.346447
H 4.516397 -1.602899 0.368425
H -3.821145 -0.389239 -3.136908
H -4.984283 -0.988643 -2.077211
H 4.859995 1.992110 0.841488
H 5.658420 0.513140 0.837741
H -2.854563 0.046528 3.317855
H -4.268715 -0.656099 2.730620
H 3.155436 -3.569927 -0.156164
H 1.552914 -3.457578 -0.653638


%chk=000257870-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000257870

0 1
O 0.249997 1.934116 -1.722117
N -4.634629 0.432804 -2.141822
N 4.857579 1.305055 0.450234
N -3.119590 -1.161237 2.226719
N 2.655754 -3.055817 0.683049
C -1.242915 0.428258 -0.584227
C 1.360443 0.287081 -0.363558
C 0.129416 0.939977 -0.935808
C -1.511881 -0.179108 0.667645
C 1.395574 -1.097224 -0.062735
C -2.281499 0.646923 -1.518940
C 2.514109 1.089991 -0.207723
C -3.606306 0.234795 -1.216097
C 3.718066 0.514202 0.277906
C -2.841289 -0.576672 0.985797
C 2.605214 -1.685349 0.404029
C -3.878772 -0.378849 0.037562
C 3.755854 -0.874011 0.584210
H -0.710459 -0.305857 1.402319
H 0.509609 -1.719315 -0.225017
H -2.044205 1.150987 -2.461716
H 2.460829 2.148327 -0.483918
H -4.903104 -0.694457 0.277701
H 4.687038 -1.324480 0.953698
H -4.445153 0.886411 -3.030099
H -5.589858 0.161731 -1.931002
H 4.837387 2.292342 0.214603
H 5.730711 0.903281 0.776729
H -2.385002 -1.273498 2.918376
H -4.069499 -1.406799 2.487212
H 3.519729 -3.496859 0.982081
H 1.840752 -3.642050 0.532605


