%chk=000190418.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000190418

0 1
O -0.880295 2.916617 0.761283
O 0.640534 2.833950 -0.762584
N -0.151590 2.300683 -0.001459
C 0.960671 0.069074 -0.006063
C 0.857725 -1.363274 0.008085
C -1.512086 0.210982 0.000079
C -0.235698 0.825283 -0.003120
C -1.580241 -1.220114 -0.014724
C -0.398836 -1.977656 -0.003531
C 2.274622 0.652719 -0.003131
C 3.404230 -0.122930 0.019725
C 2.067549 -2.153272 0.031529
C -2.754302 0.945620 -0.000416
C 3.292622 -1.561897 0.040250
C -2.870049 -1.868159 -0.037519
C -3.954926 0.298311 -0.022650
C -4.019090 -1.135498 -0.044014
C 4.760266 0.498967 0.020439
H -0.463823 -3.068836 -0.003576
H 2.366546 1.742802 -0.043741
H 1.966601 -3.239235 0.043339
H -2.722327 2.039448 0.038160
H 4.206303 -2.154303 0.059883
H -2.895067 -2.957731 -0.050251
H -4.891791 0.857611 -0.021287
H -4.998161 -1.611913 -0.062677
H 4.900391 1.152970 0.895192
H 5.574798 -0.236234 0.034987
H 4.910525 1.128413 -0.871206


%chk=000190418-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000190418

0 1
O -0.914217 2.973757 0.811792
O 0.669227 2.882469 -0.820891
N -0.158850 2.308826 -0.005032
C 0.976577 0.084177 -0.023688
C 0.864610 -1.371476 -0.003631
C -1.540981 0.230500 0.014844
C -0.243538 0.834944 -0.004720
C -1.605166 -1.228229 -0.002250
C -0.409191 -1.981752 -0.002047
C 2.294364 0.659298 -0.012737
C 3.446257 -0.132598 0.018722
C 2.064349 -2.165431 0.016894
C -2.786032 0.957529 0.001181
C 3.316832 -1.567002 0.027001
C -2.887132 -1.884534 -0.022631
C -4.005039 0.285150 -0.029903
C -4.065056 -1.148885 -0.035681
C 4.822877 0.508001 0.033525
H -0.472435 -3.077140 -0.000907
H 2.402415 1.745989 -0.047488
H 1.968060 -3.257219 0.029425
H -2.773957 2.048421 0.032391
H 4.223102 -2.182773 0.043845
H -2.911362 -2.980350 -0.032858
H -4.936316 0.861486 -0.042975
H -5.036957 -1.652647 -0.052739
H 4.953562 1.154654 0.920807
H 5.624567 -0.249424 0.046823
H 4.974531 1.146656 -0.856070


