%chk=000234412.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000234412

0 1
O 4.162679 -0.076871 1.284715
O 2.502878 -2.246468 0.867685
O 2.142783 2.250429 -1.013044
O -0.119935 -0.677612 -1.706394
N 0.622886 0.122965 0.303326
N -4.006044 -0.936752 0.110318
C 2.076797 0.010120 -0.014343
C 2.880764 0.534623 1.214915
C 2.438667 -1.465485 -0.332175
C 2.422888 0.870856 -1.262583
C -0.382994 -0.220127 -0.606711
C -1.777074 -0.012002 -0.112965
C -2.200910 1.189436 0.468791
C -2.716590 -1.050319 -0.290536
C -3.530718 1.315488 0.876066
C -4.402539 0.229800 0.684726
H 2.343312 0.369939 2.164845
H 3.116087 1.615334 1.095653
H 1.727431 -1.921983 -1.046822
H 3.470726 -1.545423 -0.731453
H 3.516984 0.865839 -1.445774
H 1.880560 0.525210 -2.162727
H 0.382342 0.481773 1.224547
H 4.067280 -1.037080 1.531193
H 1.606121 -2.371098 1.241028
H 1.181024 2.417585 -1.088567
H -1.508787 2.023120 0.594063
H -2.431153 -1.997212 -0.771975
H -3.889952 2.237989 1.328305
H -5.455617 0.280327 0.991392


%chk=000234412-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000234412

0 1
O 4.189160 0.264298 1.292297
O 2.720592 -2.156268 1.179662
O 1.768532 1.935564 -1.563093
O -0.178311 -0.398452 -1.872062
N 0.626426 0.042223 0.273077
N -4.160846 -0.476195 -0.418493
C 2.079050 -0.034740 -0.024585
C 2.799000 0.674728 1.169703
C 2.549939 -1.510847 -0.137893
C 2.469961 0.672274 -1.363981
C -0.392879 -0.098403 -0.649903
C -1.791846 0.098377 -0.126739
C -2.122390 0.957027 0.953075
C -2.852117 -0.582344 -0.783841
C -3.473817 1.081724 1.340579
C -4.453796 0.346368 0.634262
H 2.247889 0.466617 2.115719
H 2.808792 1.763122 0.995032
H 1.850587 -2.079951 -0.777783
H 3.555107 -1.541236 -0.587469
H 3.542900 0.922953 -1.294049
H 2.303051 -0.011313 -2.216306
H 0.372704 0.282430 1.234733
H 4.179696 -0.683184 1.600126
H 1.833792 -2.375071 1.559447
H 0.912584 1.734880 -2.021048
H -1.354869 1.554057 1.460556
H -2.628024 -1.228575 -1.638880
H -3.767301 1.743941 2.160621
H -5.513671 0.418398 0.902734


