%chk=000208781.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208781

0 1
O 2.079777 2.700426 0.107081
N -1.662450 -0.142141 -0.259170
N -4.523716 -0.111923 0.127439
N 0.555522 -1.044088 -0.130185
N 0.244004 1.334511 0.018944
C -2.469383 1.080409 -0.602721
C -2.296206 -0.885959 0.882920
C -3.887433 0.637871 -1.006064
C -3.708594 -1.328811 0.451013
C 1.964333 -0.892629 -0.092866
C 2.757714 -2.169973 -0.122481
C 4.235070 -1.901593 -0.452723
C 4.771339 -0.716145 0.358866
C 3.994617 0.566288 0.033711
C 2.512293 0.349764 -0.001716
C -0.259653 0.123861 -0.084625
C 1.662046 1.565826 0.041534
C -5.922903 -0.497760 -0.220391
H -1.975252 1.608526 -1.448839
H -2.508567 1.802396 0.245494
H -2.365148 -0.248128 1.795376
H -1.687452 -1.774268 1.143532
H -4.500375 1.544025 -1.207669
H -3.848096 0.050536 -1.948995
H -3.639279 -2.046544 -0.394885
H -4.196644 -1.859145 1.297455
H 2.681732 -2.663170 0.871586
H 2.339597 -2.887426 -0.856995
H 4.833691 -2.809260 -0.251337
H 4.343263 -1.691413 -1.535532
H 5.847332 -0.566983 0.150360
H 4.697509 -0.934603 1.441911
H 4.316747 0.976784 -0.948115
H 4.235163 1.361436 0.773582
H 0.142987 -1.958740 -0.294144
H -6.509547 0.418129 -0.402598
H -6.382524 -1.001373 0.645555
H -6.023312 -1.152809 -1.098009


%chk=000208781-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000208781

0 1
O 1.983927 2.600101 -1.012159
N -1.666278 0.058081 0.494275
N -4.468858 -0.276872 -0.054172
N 0.520405 -0.915757 0.440885
N 0.155903 1.339276 -0.265138
C -2.552280 1.238964 0.381492
C -2.363983 -1.169891 0.913374
C -3.744947 0.927778 -0.536796
C -3.568262 -1.448158 -0.016316
C 1.901118 -0.839116 0.164086
C 2.713165 -2.088581 0.449710
C 4.103985 -2.021335 -0.225906
C 4.755341 -0.637478 0.002514
C 3.903261 0.484669 -0.631156
C 2.427678 0.334257 -0.324306
C -0.312138 0.186305 0.209598
C 1.531713 1.500589 -0.559915
C -5.705570 -0.540660 -0.815224
H -1.943475 2.067127 -0.013442
H -2.928293 1.502645 1.390541
H -2.735298 -1.049945 1.951795
H -1.698374 -2.050160 0.887480
H -4.442080 1.785601 -0.526790
H -3.376565 0.795128 -1.585533
H -3.182037 -1.713113 -1.035643
H -4.129536 -2.318737 0.372733
H 2.838157 -2.200801 1.547405
H 2.162773 -2.986579 0.100048
H 4.746929 -2.828434 0.172419
H 3.993440 -2.196714 -1.313959
H 5.776039 -0.623548 -0.423537
H 4.857121 -0.458936 1.091967
H 4.041197 0.499247 -1.731793
H 4.229787 1.483880 -0.288907
H 0.156426 -1.779324 0.842659
H -6.367626 0.341518 -0.759185
H -6.242143 -1.398372 -0.370994
H -5.522422 -0.766750 -1.895811


