%chk=000220168.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000220168

0 1
O 1.359311 3.244068 0.101780
O -0.759547 2.842333 0.039178
O 4.030400 -2.300718 -0.060409
O 4.635519 -0.224603 0.033026
N -1.670641 0.427033 -0.076340
N 0.419581 2.474443 0.050657
N 3.792142 -1.104523 -0.018765
N -2.641356 -0.561113 -0.131870
C -0.343041 0.049314 -0.060667
C 0.688570 1.046168 0.000150
C 2.382219 -0.694179 -0.032094
C 2.044943 0.649941 0.013191
C 0.048099 -1.330905 -0.105488
C 1.367647 -1.695235 -0.091881
C -4.929774 -1.288417 -0.232201
C -3.891940 -0.200248 -0.154243
C -6.080857 -1.018009 0.730103
H 2.834061 1.423535 0.059917
H -0.738798 -2.093213 -0.150683
H 1.672599 -2.750273 -0.126049
H -1.922812 1.446666 -0.039411
H -5.302846 -1.346767 -1.279338
H -4.483194 -2.286380 -0.022562
H -4.284928 0.827488 -0.125508
H -6.603653 -0.081826 0.500476
H -5.735135 -0.957907 1.770183
H -6.825669 -1.823573 0.685147


%chk=000220168-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000220168

0 1
O 1.359748 3.305725 0.063905
O -0.866855 2.841762 -0.047502
O 4.090972 -2.344438 0.047249
O 4.698336 -0.142098 0.126660
N -1.686201 0.368195 -0.143673
N 0.391942 2.460744 -0.000141
N 3.811805 -1.080494 0.065488
N -2.656175 -0.634886 -0.205466
C -0.353908 0.027804 -0.091344
C 0.687587 1.028247 -0.021986
C 2.390211 -0.695080 0.012065
C 2.050269 0.661620 0.029036
C 0.049064 -1.349240 -0.105313
C 1.392373 -1.708870 -0.055059
C -5.029197 -1.231567 -0.318034
C -3.904484 -0.233429 -0.259892
C -6.030779 -1.046017 0.852882
H 2.821632 1.434162 0.081281
H -0.740299 -2.100944 -0.157574
H 1.702914 -2.756863 -0.066166
H -1.896769 1.388168 -0.133062
H -5.571531 -1.102639 -1.277196
H -4.605606 -2.250870 -0.312512
H -4.181925 0.840811 -0.251502
H -6.458741 -0.026534 0.860574
H -5.537742 -1.218007 1.825553
H -6.865739 -1.762163 0.758025


