%chk=000251302.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000251302

0 1
O 1.990758 -0.439118 0.697859
O 1.154944 -0.492365 -1.402664
O -0.922389 -3.588988 -0.062029
O 3.891218 2.177354 -0.064234
N -0.532637 0.696865 2.632874
C -1.597545 -0.773090 -0.363592
C -0.313850 -0.856131 0.546842
C -1.472635 -1.777983 -1.535123
C -1.735917 0.642943 -0.936291
C -2.822702 -1.125778 0.490673
C -1.344510 -3.228462 -1.142035
C 0.972079 -0.564059 -0.210204
C -0.431017 0.012289 1.707647
C -1.752337 -4.220868 -2.191846
C 3.322374 -0.073109 0.211178
C 3.705395 1.188680 0.977251
C 4.018945 3.520948 0.434139
H -0.237889 -1.941922 0.912127
H -2.333614 -1.636103 -2.218924
H -0.582782 -1.505201 -2.160216
H -1.799642 1.400065 -0.145256
H -2.639515 0.747770 -1.546415
H -0.881268 0.910839 -1.573997
H -2.999027 -0.390241 1.285500
H -3.735943 -1.159241 -0.113025
H -2.714053 -2.105225 0.976276
H -2.840746 -4.228060 -2.339096
H -1.463151 -5.244042 -1.903392
H -1.292204 -4.013801 -3.166512
H 3.304778 0.100873 -0.886502
H 3.943675 -0.949374 0.457721
H 4.653211 1.078901 1.531322
H 2.900132 1.501675 1.669910
H 4.148405 4.103218 -0.487252
H 4.898626 3.613198 1.077082
H 3.108533 3.826343 0.958804


%chk=000251302-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000251302

0 1
O 2.213370 -0.679629 0.651530
O 1.339726 -0.634625 -1.509991
O -1.036462 -3.544970 0.113654
O 3.162762 2.013147 0.022521
N -0.188136 1.089120 2.432000
C -1.459089 -0.627478 -0.420660
C -0.168283 -0.736672 0.485186
C -1.461572 -1.744180 -1.508321
C -1.512701 0.751327 -1.129027
C -2.706952 -0.789964 0.490741
C -1.399401 -3.199647 -1.047626
C 1.178405 -0.659222 -0.271334
C -0.172479 0.269445 1.564998
C -1.795866 -4.244366 -2.082074
C 3.587023 -0.345175 0.180855
C 3.945703 1.020438 0.755055
C 3.046954 3.287029 0.734839
H -0.198146 -1.745863 0.952612
H -2.370789 -1.624157 -2.131911
H -0.605355 -1.586914 -2.196970
H -1.511566 1.571032 -0.387713
H -2.441655 0.837224 -1.722728
H -0.652986 0.891085 -1.806316
H -2.765321 0.027701 1.230652
H -3.625852 -0.753650 -0.123293
H -2.689889 -1.749251 1.036768
H -2.901068 -4.292764 -2.145854
H -1.420786 -5.236584 -1.786548
H -1.424107 -3.980240 -3.088300
H 3.603985 -0.334676 -0.922552
H 4.244600 -1.136331 0.576767
H 5.036785 1.204941 0.631121
H 3.701938 1.042440 1.838950
H 2.438380 3.940091 0.090398
H 4.039870 3.756628 0.900129
H 2.536659 3.153510 1.711045


