%chk=000212537.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212537

0 1
O 1.771131 0.494471 0.335967
O 1.697351 -1.472918 -0.873822
N 3.669067 -0.748599 0.147598
C -3.031351 -0.867670 -0.134928
C -1.945632 0.155288 0.219390
C -3.101155 -0.949803 -1.672353
C -4.410186 -0.460935 0.418162
C -2.665337 -2.244744 0.452251
C -0.594703 -0.212974 0.085422
C -2.257558 1.457720 0.634149
C 0.388812 0.725652 0.381469
C -1.245777 2.382055 0.924642
C 0.097375 2.033303 0.803917
C 2.323912 -0.657711 -0.234514
C 4.528173 -1.603200 -0.711471
C 4.341290 0.432633 0.739464
H -3.856958 -1.670635 -1.998613
H -3.352951 0.020199 -2.113729
H -2.141790 -1.262904 -2.101522
H -4.762077 0.481940 -0.013298
H -5.164739 -1.220458 0.186102
H -4.386609 -0.347143 1.507280
H -3.449735 -2.982197 0.255561
H -1.737247 -2.639279 0.020732
H -2.523753 -2.189851 1.536823
H -0.323000 -1.216079 -0.257158
H -3.294798 1.771460 0.732388
H -1.512589 3.388305 1.247412
H 0.897916 2.732265 1.022887
H 3.932304 -2.434291 -1.138151
H 5.323394 -2.046733 -0.088367
H 4.991481 -1.049380 -1.543178
H 4.628740 1.187110 -0.010214
H 5.243694 0.103762 1.281044
H 3.664501 0.917341 1.470858


%chk=000212537-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000212537

0 1
O 1.791114 0.503370 0.381447
O 1.749400 -1.666809 -0.587734
N 3.757681 -0.532304 -0.173060
C -3.074649 -0.853952 -0.174652
C -1.992700 0.148234 0.298155
C -2.920756 -1.097417 -1.706458
C -4.511950 -0.338705 0.093875
C -2.889434 -2.204468 0.581472
C -0.623051 -0.184746 0.100482
C -2.310084 1.379541 0.922529
C 0.383881 0.705837 0.524669
C -1.286538 2.262269 1.342488
C 0.067853 1.934949 1.148200
C 2.382347 -0.661442 -0.167534
C 4.561930 -1.643594 -0.704662
C 4.495891 0.641177 0.317674
H -3.680698 -1.822262 -2.054636
H -3.055001 -0.155590 -2.269749
H -1.924709 -1.502983 -1.957006
H -4.714462 0.609158 -0.438696
H -5.244397 -1.086062 -0.262518
H -4.695270 -0.179096 1.172691
H -3.644722 -2.938307 0.241778
H -1.889375 -2.637064 0.402495
H -3.007910 -2.063899 1.671660
H -0.333578 -1.123647 -0.372543
H -3.353168 1.662386 1.087616
H -1.547947 3.211066 1.824248
H 0.875182 2.601836 1.464784
H 3.887504 -2.446838 -1.035389
H 5.241467 -2.037224 0.075673
H 5.171541 -1.302822 -1.563633
H 5.108879 1.074709 -0.496595
H 5.173097 0.349419 1.144193
H 3.793829 1.401279 0.680932


