%chk=000262757.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000262757

0 1
O 4.480186 2.677193 -0.436646
O 0.612891 0.409002 -0.549927
O 4.298673 2.356606 1.799203
O -2.326223 2.124083 0.889884
O -1.268849 -2.383225 1.020062
N 2.138321 0.595030 1.137087
N -1.527276 -0.060759 1.156608
C 4.228255 -0.451604 0.214053
C 3.548584 -1.752687 -0.271712
C 3.275896 0.755498 0.209407
C 4.553984 -2.909216 -0.193689
C 2.995877 -1.607693 -1.691774
C -0.222175 0.261091 1.740840
C 0.841306 0.417265 0.644243
C 4.055371 1.994875 0.673358
C -3.515847 0.170297 -0.035510
C -3.192629 -1.215748 0.007864
C -2.447206 0.948699 0.675746
C -1.898653 -1.396947 0.746696
C -4.657358 0.618040 -0.664322
C -4.010328 -2.158279 -0.576965
C -5.498608 -0.348075 -1.266843
C -5.183405 -1.700980 -1.224109
C 5.249278 3.890588 -0.211652
H 4.643552 -0.611748 1.228476
H 5.096982 -0.223423 -0.437304
H 2.694566 -1.982296 0.414756
H 2.878082 0.926130 -0.838249
H 2.365212 0.560016 2.128141
H 4.083878 -3.855943 -0.484700
H 5.406343 -2.754108 -0.863796
H 4.946658 -3.040154 0.819633
H 3.759110 -1.278452 -2.402706
H 2.593187 -2.557823 -2.059968
H 2.167261 -0.881949 -1.726397
H 0.065021 -0.549159 2.455179
H -0.306625 1.215266 2.320880
H -4.907220 1.679299 -0.702243
H -3.765406 -3.220860 -0.547877
H -6.406256 -0.014442 -1.772676
H -5.843449 -2.430665 -1.696162
H 4.637636 4.612786 0.338454
H 5.463086 4.227625 -1.231629
H 6.161219 3.650443 0.342984


%chk=000262757-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000262757

0 1
O 5.168971 2.401777 -0.161609
O 0.547150 0.817597 -0.804713
O 4.163472 2.415638 1.940392
O -2.884548 2.251707 0.633545
O -0.748960 -1.921631 1.038753
N 2.047436 0.938520 0.977392
N -1.557278 0.310847 0.994123
C 3.988929 -0.417831 0.096916
C 3.162408 -1.556024 -0.557905
C 3.262890 0.965588 0.152803
C 3.898057 -2.901858 -0.349141
C 2.905899 -1.295083 -2.061140
C -0.356006 0.965969 1.485489
C 0.781512 0.891525 0.436710
C 4.210196 2.003643 0.755791
C -3.631196 -0.044334 0.003746
C -2.990833 -1.302177 0.129299
C -2.717660 1.011638 0.545735
C -1.645809 -1.090218 0.752320
C -4.912603 0.072261 -0.554257
C -3.611811 -2.484641 -0.298430
C -5.549015 -1.118657 -0.991779
C -4.908575 -2.377525 -0.865544
C 6.187451 3.361873 0.338310
H 4.260722 -0.707340 1.132845
H 4.933925 -0.281515 -0.465809
H 2.181451 -1.616958 -0.044670
H 2.974042 1.268460 -0.868172
H 2.181791 1.062209 1.985597
H 3.314782 -3.735740 -0.780549
H 4.889158 -2.891909 -0.843682
H 4.054112 -3.118045 0.724616
H 3.860182 -1.158198 -2.607080
H 2.377185 -2.153741 -2.514487
H 2.271581 -0.405004 -2.214606
H -0.039465 0.507819 2.439691
H -0.616419 2.026513 1.662129
H -5.395850 1.049721 -0.648022
H -3.107134 -3.450600 -0.198487
H -6.549024 -1.067068 -1.435492
H -5.423834 -3.279220 -1.213472
H 5.699045 4.298991 0.652567
H 6.855817 3.528494 -0.517200
H 6.730757 2.928125 1.194178


