%chk=000238721.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000238721

0 1
O 0.946153 -1.515469 0.502904
O 4.148477 1.371877 -0.698802
N 1.117424 0.046412 -1.145755
N 3.510655 -0.169728 0.849763
C -1.016180 -0.208757 0.007879
C 0.409159 -0.632172 -0.151465
C 2.527211 -0.276364 -1.420592
C -2.018687 -1.183681 -0.083516
C -1.344545 1.125756 0.281131
C -3.356924 -0.815353 0.081491
C -2.684287 1.485487 0.449844
C -3.689361 0.517241 0.346306
C 3.461795 0.407891 -0.407622
H 2.681630 -1.383674 -1.398895
H 2.801821 0.069269 -2.444561
H 0.718893 0.825798 -1.659140
H -1.750727 -2.224689 -0.273606
H -0.562588 1.879095 0.376293
H -4.140048 -1.569426 0.008943
H -2.945391 2.520992 0.665480
H -4.733478 0.801771 0.476810
H 4.070179 0.248877 1.576562
H 2.868719 -0.908954 1.129550


%chk=000238721-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000238721

0 1
O 0.879739 -1.651049 0.076114
O 4.478135 1.181865 -0.273487
N 1.202883 0.344612 -1.049991
N 3.433854 -0.591462 0.839214
C -1.022430 -0.142186 -0.098790
C 0.408271 -0.534386 -0.341024
C 2.602139 0.026433 -1.385816
C -1.924437 -1.172459 0.272409
C -1.498041 1.192526 -0.199883
C -3.282219 -0.879815 0.514617
C -2.856209 1.485214 0.049704
C -3.753186 0.449590 0.401049
C 3.597541 0.273030 -0.219762
H 2.652740 -1.036467 -1.685454
H 2.920967 0.661153 -2.226104
H 0.818975 1.230502 -1.378095
H -1.533166 -2.190420 0.367216
H -0.819759 2.022445 -0.434331
H -3.971573 -1.683775 0.794073
H -3.212060 2.518687 -0.020510
H -4.807080 0.678850 0.593111
H 4.036372 -0.489755 1.655890
H 2.668444 -1.280933 0.818850


