%chk=000233556.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000233556

0 1
O -0.459286 -1.535600 1.691655
O -0.764080 -2.542896 -0.312659
O 1.794133 -0.332747 -1.932741
O -1.065366 3.072570 0.415117
O -1.596710 2.259354 -1.519461
N -1.387786 2.163038 -0.328963
C -0.356639 -0.116089 -0.202277
C -1.494921 0.779325 0.334482
C 1.030498 0.396113 0.208562
C -2.866238 0.199378 0.087590
C -0.558895 -1.537513 0.313231
C 2.093474 0.061450 -0.827471
C -3.680505 -0.109201 1.188209
C -3.327078 -0.042602 -1.214625
C 3.514898 0.230423 -0.404019
C -4.946543 -0.662756 0.983139
C -4.594864 -0.595867 -1.412684
C -5.404454 -0.907733 -0.316070
C 3.904466 1.158500 0.572360
C 4.484192 -0.565142 -1.036529
C -0.640065 -2.814795 2.357326
C 5.251865 1.279219 0.920975
C 5.829779 -0.446862 -0.679975
C 6.213688 0.474665 0.299108
H -0.411564 -0.166875 -1.334719
H -1.336773 0.938759 1.441913
H 1.317727 -0.015174 1.203120
H 1.025356 1.498739 0.358811
H -3.329642 0.076782 2.202939
H -2.702006 0.213951 -2.074681
H -5.578381 -0.902775 1.837251
H -4.949778 -0.784773 -2.425864
H -6.391786 -1.340865 -0.473194
H 3.167489 1.798345 1.056999
H 4.175697 -1.271006 -1.813218
H -0.409734 -2.577556 3.400872
H 0.053441 -3.553097 1.941030
H -1.676492 -3.142763 2.228585
H 5.554550 2.003192 1.676428
H 6.578430 -1.068607 -1.169652
H 7.263704 0.569997 0.576004


%chk=000233556-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000233556

0 1
O -0.120161 -1.809204 1.533265
O -1.174462 -2.523944 -0.420974
O 1.905222 -1.619833 -0.865333
O -1.374447 3.061614 0.885191
O -1.189240 2.379014 -1.282399
N -1.345379 2.156690 -0.025526
C -0.398481 -0.176617 -0.215612
C -1.527184 0.676261 0.436224
C 0.991188 0.387277 0.155349
C -2.952150 0.243902 0.123316
C -0.597442 -1.631220 0.227914
C 2.143247 -0.491737 -0.340177
C -3.856940 0.039138 1.193934
C -3.391696 0.046668 -1.209761
C 3.548481 0.003821 -0.176815
C -5.184891 -0.368284 0.939036
C -4.719882 -0.353682 -1.463251
C -5.619014 -0.564506 -0.391497
C 3.853513 1.252537 0.431087
C 4.611146 -0.817180 -0.645285
C -0.240100 -3.187307 2.067078
C 5.194604 1.669412 0.566138
C 5.948895 -0.399159 -0.511505
C 6.244229 0.846302 0.095227
H -0.526595 -0.171444 -1.311028
H -1.374748 0.729610 1.526934
H 1.082016 0.484865 1.255228
H 1.105614 1.401856 -0.271525
H -3.521723 0.197297 2.226121
H -2.704397 0.211933 -2.045638
H -5.876612 -0.528700 1.773026
H -5.053320 -0.505699 -2.495313
H -6.649101 -0.878755 -0.592820
H 3.053905 1.903119 0.800514
H 4.356201 -1.775457 -1.109934
H 0.156329 -3.130919 3.090575
H 0.354165 -3.878511 1.446583
H -1.295374 -3.508124 2.061757
H 5.422373 2.632772 1.034770
H 6.761158 -1.036487 -0.877127
H 7.284856 1.173187 0.199158


