%chk=000239538.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239538

0 1
O 2.858628 -1.089769 0.000399
O 1.636628 3.148337 0.000525
O 3.758132 0.976492 -0.000557
N -0.824510 0.568093 0.000093
N 0.298648 -0.167837 -0.000074
C -2.131987 -0.044183 -0.000027
C 1.360682 0.705580 0.000070
C -0.547915 1.953021 0.000389
C 0.848902 2.053403 0.000341
C -3.276945 0.771883 0.000024
C -2.246073 -1.446425 -0.000189
C 2.766374 0.281747 -0.000084
C -4.538081 0.171849 -0.000083
C -3.516582 -2.024188 -0.000295
C -4.662063 -1.221139 -0.000242
C 4.222922 -1.642729 0.000270
C 3.997228 -3.139264 0.000890
H -1.298268 2.715566 0.000569
H -3.194323 1.857567 0.000142
H -1.350802 -2.076210 -0.000230
H -5.430785 0.797981 -0.000043
H -3.612224 -3.110846 -0.000421
H -5.649723 -1.680571 -0.000325
H 4.736377 -1.271839 -0.903338
H 4.736824 -1.271157 0.903344
H 4.947219 -3.685258 0.000878
H 3.420000 -3.454680 0.881464
H 3.419594 -3.455348 -0.879178
H 1.092722 3.982425 0.000789


%chk=000239538-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239538

0 1
O 2.816889 -1.149702 0.000417
O 1.666718 3.181801 0.000503
O 3.726310 1.004175 -0.000190
N -0.863166 0.623019 0.000098
N 0.263167 -0.175798 0.000010
C -2.159094 0.010037 -0.000009
C 1.318947 0.701024 0.000145
C -0.551477 1.984209 0.000277
C 0.847510 2.062442 0.000314
C -3.331533 0.803777 -0.000058
C -2.248948 -1.403530 -0.000068
C 2.723245 0.246908 0.000072
C -4.595775 0.176724 -0.000158
C -3.518439 -2.015222 -0.000171
C -4.697889 -1.232925 -0.000214
C 4.210386 -1.685872 0.000319
C 4.091019 -3.206860 0.000740
H -1.303293 2.767594 0.000382
H -3.276746 1.896827 -0.000031
H -1.326822 -1.989502 -0.000032
H -5.500779 0.793895 -0.000196
H -3.585301 -3.108558 -0.000215
H -5.681374 -1.714400 -0.000293
H 4.735072 -1.301549 -0.893725
H 4.735384 -1.301077 0.893975
H 5.099362 -3.660129 0.000677
H 3.549576 -3.558149 0.895783
H 3.549252 -3.558618 -0.893923
H 1.128400 4.011960 0.000673


