%chk=000283945.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000283945

0 1
O 0.391437 -1.289332 -3.108405
O -0.261881 2.214175 -2.395208
O 2.189062 0.232903 2.016260
O -4.220836 -1.057034 -0.022385
N 1.180169 0.384521 1.076048
N -3.455785 -0.882877 -1.165188
C 0.039789 -0.944731 -1.767947
C 0.954567 0.275878 -1.411631
C -1.221127 -0.004918 -1.779969
C -0.305315 1.206597 -1.416638
C 0.022655 -2.153440 -0.871880
C 1.708820 0.192908 -0.144952
C -2.285258 -0.326510 -0.808133
C 3.124837 -0.103057 -0.017524
C -2.262432 -0.125737 0.629683
C 3.381635 -0.066533 1.328694
C -3.474410 -0.582861 1.076148
C 4.554800 -0.255291 2.185614
C -4.150215 -0.689941 2.371840
H 1.647483 0.508399 -2.255178
H -1.645581 0.087889 -2.806910
H -0.531960 1.747848 -0.480701
H 0.975221 -2.697931 -0.917245
H -0.142115 -1.876805 0.182495
H -0.782428 -2.851361 -1.136649
H -0.066691 -2.101065 -3.405531
H -0.091565 1.850893 -3.292460
H 3.795177 -0.300790 -0.829051
H -1.445625 0.290567 1.192736
H 5.341846 0.484973 1.960029
H 4.308183 -0.149964 3.256342
H 4.999601 -1.255544 2.049584
H -4.317914 0.304719 2.820012
H -3.553034 -1.273886 3.092181
H -5.135410 -1.179162 2.286918


%chk=000283945-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000283945

0 1
O 0.381078 -1.335707 -3.207465
O -0.220859 2.223145 -2.504847
O 2.158395 0.181974 2.036890
O -4.318400 -0.848631 0.020259
N 1.111504 0.335024 1.019473
N -3.521234 -0.697152 -1.207257
C 0.038592 -0.993943 -1.813585
C 0.983586 0.224134 -1.448843
C -1.228878 -0.024791 -1.777756
C -0.264318 1.188346 -1.491390
C 0.030489 -2.232845 -0.925810
C 1.752218 0.157296 -0.165217
C -2.303982 -0.283594 -0.769767
C 3.157439 -0.102282 0.020758
C -2.253491 -0.155141 0.667833
C 3.375206 -0.078362 1.387989
C -3.512318 -0.507842 1.119683
C 4.572747 -0.255103 2.263773
C -4.156080 -0.588264 2.466033
H 1.675968 0.405846 -2.288115
H -1.687385 0.042981 -2.780572
H -0.456617 1.716832 -0.546965
H 0.988893 -2.773366 -1.023063
H -0.117645 -1.970301 0.134650
H -0.793483 -2.911481 -1.219016
H -0.232175 -2.049820 -3.521680
H -0.076620 1.801130 -3.390942
H 3.893244 -0.275505 -0.760259
H -1.391253 0.149611 1.258633
H 4.768509 0.656043 2.857296
H 4.426692 -1.088651 2.974026
H 5.462926 -0.469991 1.651780
H -5.015384 0.102979 2.537232
H -3.428945 -0.321868 3.249345
H -4.532722 -1.607203 2.667896


