%chk=000235055.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000235055

0 1
O -0.024862 3.301604 0.105808
O -1.238271 0.881741 0.268073
N 2.484679 0.691519 -0.493651
C 4.095356 -1.200630 -0.662452
C 3.049126 -0.489407 0.229791
C 1.579257 1.502924 0.370353
C 0.543274 2.172304 -0.561388
C 5.413638 -0.418999 -0.706481
C 4.330213 -2.623312 -0.140972
C -0.563770 1.193932 -0.989475
C -2.321879 0.032173 0.230987
C -2.820803 -0.594690 -0.916468
C -2.902886 -0.160773 1.502031
C -3.932579 -1.434703 -0.779537
C -4.006111 -1.001709 1.604040
C -4.525111 -1.640571 0.467304
H 3.684190 -1.266874 -1.702273
H 2.204362 -1.183910 0.439466
H 3.497137 -0.229944 1.211664
H 1.049340 0.860076 1.108332
H 2.100691 2.288317 0.957192
H 1.026294 2.628120 -1.457953
H 3.249770 1.285599 -0.834703
H 5.275802 0.585375 -1.119801
H 5.856961 -0.310961 0.289219
H 6.152552 -0.927818 -1.336163
H 4.706253 -2.624799 0.887706
H 5.066872 -3.152377 -0.756063
H 3.408604 -3.215533 -0.158286
H -0.143804 0.265472 -1.416584
H -1.290743 1.662585 -1.672419
H -0.652771 3.006681 0.806176
H -2.369716 -0.446661 -1.890847
H -2.484281 0.343809 2.367817
H -4.336173 -1.931822 -1.661844
H -4.472035 -1.165509 2.575874
H -5.387978 -2.294330 0.561028


%chk=000235055-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000235055

0 1
O -0.022525 3.409123 0.492785
O -1.246636 0.937521 0.393250
N 2.455895 0.664801 -0.271519
C 3.884995 -1.397881 -0.481227
C 3.247325 -0.349432 0.462464
C 1.670321 1.590810 0.574384
C 0.595575 2.316729 -0.270947
C 4.863950 -0.752722 -1.492420
C 4.602014 -2.486109 0.351795
C -0.474074 1.351847 -0.798276
C -2.317430 0.045103 0.215920
C -2.690671 -0.506935 -1.034300
C -3.032996 -0.292125 1.391735
C -3.786998 -1.398902 -1.094446
C -4.122269 -1.182140 1.313966
C -4.507655 -1.741611 0.070446
H 3.058147 -1.869275 -1.050115
H 2.557380 -0.868219 1.156675
H 4.056804 0.103600 1.091651
H 1.165410 0.997391 1.360037
H 2.280189 2.370259 1.086756
H 1.078724 2.811629 -1.134685
H 3.046329 1.183628 -0.936634
H 4.350407 -0.057368 -2.182359
H 5.664185 -0.195750 -0.966122
H 5.349298 -1.527603 -2.114239
H 5.441053 -2.051484 0.929249
H 5.017333 -3.275133 -0.301762
H 3.909892 -2.967621 1.067985
H 0.013156 0.476324 -1.267896
H -1.149559 1.863225 -1.511306
H -0.687808 2.991030 1.100797
H -2.144158 -0.257001 -1.948138
H -2.722438 0.148351 2.344543
H -4.074736 -1.825452 -2.062096
H -4.672526 -1.439386 2.225955
H -5.355307 -2.432324 0.013596


