%chk=000194756.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000194756

0 1
O -0.406852 -2.185474 0.085871
O -3.296832 -1.808364 0.239469
O 4.773018 -0.841845 -0.107994
N 0.298136 2.414937 -0.049905
C -0.170196 0.158196 0.050586
C -0.741025 1.474602 0.021950
C 1.267216 0.306901 -0.009421
C -2.138349 1.703040 0.077713
C 1.536649 1.717076 -0.070843
C -1.026383 -0.954796 0.125609
C -2.969476 0.581769 0.138978
C -2.410475 -0.729932 0.144401
C 2.319379 -0.612077 -0.019894
C 2.844718 2.215942 -0.138583
C -2.643298 3.108313 0.065868
C -4.455887 0.714303 0.202196
C 3.611891 -0.092503 -0.088118
C 3.886759 1.299984 -0.146248
C -0.905202 -3.188577 1.013779
C -3.585090 -2.404236 -1.057067
C 4.639434 -2.282166 -0.067427
H 0.192414 3.408318 -0.084136
H 2.098214 -1.674986 0.021231
H 3.038314 3.283857 -0.184054
H -3.738069 3.167549 0.122923
H -2.253790 3.677647 0.921537
H -2.348671 3.628534 -0.856235
H -4.861326 1.135060 -0.727323
H -4.942050 -0.263204 0.364477
H -4.766888 1.363144 1.032612
H 4.924431 1.623507 -0.197518
H -0.606519 -2.903964 2.026608
H -0.384125 -4.089801 0.676165
H -1.994360 -3.296746 0.941430
H -4.057878 -1.666619 -1.710198
H -4.277987 -3.209822 -0.796413
H -2.664054 -2.791827 -1.503033
H 4.161707 -2.592772 0.866221
H 5.687013 -2.606608 -0.102000
H 4.088288 -2.637556 -0.943115


%chk=000194756-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000194756

0 1
O -0.523135 -2.241969 0.037541
O -3.367737 -1.821824 0.111473
O 4.785309 -0.914349 -0.175306
N 0.283721 2.417305 0.010328
C -0.205625 0.171572 0.020874
C -0.772402 1.489270 0.037722
C 1.241478 0.318195 -0.027009
C -2.163790 1.742538 0.096745
C 1.511402 1.727853 -0.031230
C -1.077354 -0.938682 0.066141
C -3.030018 0.614243 0.110450
C -2.476716 -0.707631 0.080745
C 2.308420 -0.613650 -0.077031
C 2.832073 2.223685 -0.075734
C -2.661038 3.176827 0.135875
C -4.540549 0.776713 0.158286
C 3.626765 -0.109755 -0.121699
C 3.886121 1.292518 -0.118604
C -0.821156 -3.067538 1.232946
C -3.427322 -2.564377 -1.168091
C 4.584992 -2.361831 -0.196215
H 0.176445 3.428048 0.016025
H 2.082804 -1.682087 -0.090365
H 3.044741 3.298119 -0.078556
H -3.759778 3.236225 0.145865
H -2.295560 3.706335 1.038753
H -2.310180 3.750310 -0.745673
H -4.920845 1.330356 -0.721185
H -5.025004 -0.211065 0.184195
H -4.859047 1.334081 1.059262
H 4.929016 1.621545 -0.154606
H -0.369055 -2.608054 2.132226
H -0.356529 -4.046334 1.035845
H -1.911363 -3.174255 1.370182
H -3.806255 -1.910248 -1.976968
H -4.129664 -3.395811 -0.998180
H -2.428878 -2.953802 -1.438511
H 4.070621 -2.712372 0.720746
H 5.595596 -2.794568 -0.242605
H 4.002297 -2.676732 -1.084559


