%chk=000298044.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298044

0 1
O 1.504750 -0.706851 0.856400
O 1.026558 -0.522211 -1.377021
N -0.566521 -0.088000 0.310839
C 2.920546 -1.055302 0.557909
C 3.713660 0.250322 0.592125
C 3.244681 -2.025958 1.695854
C 3.874923 0.866771 -0.802216
C 4.506341 -2.842659 1.391465
C 4.544420 2.245679 -0.733551
C 4.841894 -3.798179 2.533348
C 4.719301 2.853062 -2.123592
C 0.682310 -0.440781 -0.217379
C -1.720778 0.243491 -0.464351
C -2.931677 0.583134 0.254292
C -4.084460 0.915321 -0.505203
C -1.694029 0.244121 -1.845520
C -3.021737 0.600051 1.681509
C -4.028375 0.908078 -1.934256
C -2.862024 0.580498 -2.578282
C -5.297507 1.255813 0.177299
C -4.195920 0.929832 2.311439
C -5.351405 1.262779 1.547755
H 2.942275 -1.548795 -0.439306
H 4.709953 0.077469 1.045145
H 3.202675 0.965940 1.270012
H 3.354908 -1.479515 2.652431
H 2.378455 -2.702951 1.852513
H 4.467058 0.191922 -1.449945
H 2.883412 0.950316 -1.297305
H 4.367808 -3.416845 0.453149
H 5.363085 -2.163788 1.207844
H 3.939405 2.926876 -0.103280
H 5.529451 2.164615 -0.234283
H 5.741960 -4.382226 2.308183
H 5.026097 -3.261704 3.471283
H 4.028785 -4.510092 2.718130
H 3.756225 2.971400 -2.634808
H 5.185571 3.842776 -2.068708
H 5.351047 2.225925 -2.762801
H -0.658127 -0.074207 1.334116
H -0.782030 -0.012010 -2.396136
H -2.141613 0.346510 2.274080
H -4.924206 1.166025 -2.494780
H -2.807420 0.571462 -3.667648
H -6.174037 1.508467 -0.418097
H -4.263017 0.942319 3.397870
H -6.270772 1.520801 2.071774


%chk=000298044-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000298044

0 1
O 1.671648 -0.151835 0.442522
O 0.755618 -1.613547 -1.169101
N -0.539339 -0.024962 0.035706
C 3.019523 -0.804555 0.282518
C 4.047554 0.297212 0.573943
C 3.079018 -2.018980 1.229514
C 4.027596 1.457895 -0.444860
C 4.334801 -2.901222 1.027606
C 5.091318 2.537511 -0.143026
C 4.302191 -4.165120 1.913808
C 5.066600 3.701654 -1.156939
C 0.623506 -0.694445 -0.321644
C -1.851498 -0.215753 -0.470058
C -2.922564 0.572673 0.112035
C -4.266776 0.391475 -0.402218
C -2.123184 -1.131705 -1.499419
C -2.726831 1.521510 1.171919
C -4.509167 -0.550389 -1.454797
C -3.453703 -1.292462 -1.984072
C -5.339573 1.161990 0.157885
C -3.792759 2.256903 1.697622
C -5.114896 2.077970 1.185980
H 3.089954 -1.148176 -0.768573
H 5.052829 -0.169071 0.578665
H 3.871872 0.688081 1.596498
H 3.030849 -1.665422 2.278924
H 2.180476 -2.640361 1.050394
H 4.194290 1.054854 -1.465786
H 3.021720 1.920802 -0.450175
H 4.403007 -3.200090 -0.038195
H 5.250751 -2.320355 1.253142
H 4.928493 2.933627 0.880363
H 6.097652 2.070316 -0.138624
H 5.204533 -4.785395 1.763493
H 4.249607 -3.897050 2.985819
H 3.419125 -4.788292 1.679680
H 4.081118 4.204489 -1.158160
H 5.833942 4.461792 -0.921221
H 5.256360 3.336458 -2.183946
H -0.399921 0.682111 0.757755
H -1.305494 -1.718875 -1.921210
H -1.733570 1.692990 1.604537
H -5.530340 -0.676014 -1.831791
H -3.635443 -2.014110 -2.787800
H -6.349991 1.014157 -0.241679
H -3.614827 2.972856 2.507271
H -5.944172 2.658562 1.603990


