%chk=000253614.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253614

0 1
O 0.343439 -0.175542 -2.209668
O -2.321584 5.533943 -0.480247
O -3.542683 -4.471649 0.309613
N 1.961351 0.944236 -0.111985
C 0.516011 0.655981 0.039034
C -0.258371 1.952115 -0.075948
C 0.017830 -0.332396 -1.052299
C -0.886437 -1.425189 -0.620677
C -0.787946 2.540762 1.078108
C -0.426329 2.587272 -1.322865
C 2.919865 -0.032255 0.262461
C -1.496317 3.744885 1.008743
C -1.122763 3.783336 -1.418418
C -1.655221 4.353995 -0.241440
C -0.748667 -2.066846 0.616218
C -1.894733 -1.845764 -1.516112
C 4.236698 0.106989 -0.240935
C 2.631423 -1.058536 1.184909
C -1.607961 -3.101178 0.988828
C -2.769213 -2.863197 -1.167761
C -2.616427 -3.485215 0.092164
C 5.235062 -0.758498 0.194712
C 3.650643 -1.914976 1.605802
C 4.951405 -1.773255 1.118667
C -2.904177 6.225204 0.651038
C -3.486897 -5.200624 1.561541
H 0.350314 0.213338 1.060109
H 2.172013 1.456201 -0.974403
H -0.647735 2.064978 2.049446
H -0.009942 2.127299 -2.225758
H -1.901669 4.185880 1.912462
H -1.266204 4.288314 -2.371350
H 0.057699 -1.768012 1.299363
H -1.975667 -1.357624 -2.492448
H 4.469442 0.889432 -0.958184
H 1.623231 -1.187421 1.576204
H -1.484175 -3.591547 1.947956
H -3.558825 -3.197215 -1.838030
H 6.248944 -0.647547 -0.190215
H 3.424076 -2.704284 2.322084
H 5.738009 -2.444260 1.449781
H -2.124640 6.519009 1.359706
H -3.672790 5.605077 1.120695
H -3.349476 7.105852 0.169326
H -3.656663 -4.523376 2.403197
H -2.536282 -5.734694 1.647761
H -4.323460 -5.903299 1.446616


%chk=000253614-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000253614

0 1
O 0.820644 -0.652385 -2.114753
O -2.649221 5.122013 -0.199481
O -3.799999 -4.457016 0.210547
N 2.125283 0.886247 -0.159924
C 0.745334 0.457985 0.064489
C -0.191190 1.671415 0.017080
C 0.281536 -0.622716 -0.969238
C -0.795556 -1.583876 -0.591947
C -0.505937 2.371245 1.204921
C -0.711194 2.156199 -1.213418
C 3.245582 0.093104 0.125896
C -1.322310 3.523721 1.187143
C -1.521833 3.304665 -1.250559
C -1.831730 3.992461 -0.050425
C -1.542426 -1.486663 0.612164
C -1.094976 -2.650173 -1.491431
C 4.543944 0.577807 -0.214216
C 3.144306 -1.169203 0.781825
C -2.555093 -2.417445 0.920649
C -2.092183 -3.586175 -1.197395
C -2.828545 -3.474399 0.013686
C 5.694742 -0.170351 0.095709
C 4.308270 -1.904262 1.094669
C 5.591875 -1.418097 0.759041
C -2.992282 5.876796 1.008372
C -4.600631 -4.399319 1.439127
H 0.690512 0.016872 1.078780
H 2.251292 1.654806 -0.819185
H -0.094117 2.022663 2.160080
H -0.482497 1.629204 -2.146489
H -1.544236 4.042702 2.124327
H -1.928247 3.685629 -2.192300
H -1.360388 -0.664194 1.311135
H -0.517525 -2.715869 -2.419220
H 4.639477 1.545740 -0.722715
H 2.165828 -1.593104 1.030818
H -3.120447 -2.312041 1.850986
H -2.326007 -4.411061 -1.876851
H 6.679911 0.223531 -0.180711
H 4.205443 -2.873936 1.596286
H 6.489107 -1.997839 0.999243
H -2.087100 6.283808 1.499791
H -3.556396 5.251626 1.727802
H -3.627355 6.703699 0.658708
H -5.182088 -3.459148 1.493658
H -3.961874 -4.498176 2.337565
H -5.285502 -5.256791 1.373559


