%chk=000271672.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000271672

0 1
O 1.740625 1.273254 -0.501600
O 3.217221 -1.273418 0.916946
O 0.753696 0.942725 1.507853
O 2.955260 -2.082079 -1.181088
N -1.815727 -1.060633 -0.072181
C 1.073498 -0.955587 -0.045622
C 0.363796 -1.816193 1.019467
C 0.331154 -1.008406 -1.400087
C -1.113463 -1.421207 1.198299
C -1.088761 -1.583178 -1.263284
C 1.143943 0.496448 0.457347
C 2.498001 -1.505677 -0.225479
C -2.331079 0.274419 -0.203707
C -2.251938 1.227413 0.832016
C -3.049574 0.600927 -1.377672
C 1.816346 2.719644 -0.265794
C 4.608682 -1.733735 0.967040
C -2.894873 2.458324 0.706367
C -3.680899 1.837727 -1.489916
C -3.610721 2.773426 -0.451928
C 0.499202 3.353848 -0.653729
C 4.649321 -3.228792 1.196412
H 0.441365 -2.884856 0.736759
H 0.890993 -1.713606 1.992750
H 0.293207 0.005763 -1.851271
H 0.907732 -1.620818 -2.128964
H -1.678104 -2.280864 1.627234
H -1.179306 -0.590625 1.944826
H -1.675850 -1.369011 -2.184336
H -1.054578 -2.692607 -1.171449
H -1.672129 1.009927 1.734713
H -3.128549 -0.121886 -2.187289
H 2.082508 2.892314 0.792252
H 2.651963 2.993573 -0.935131
H 5.109531 -1.429862 0.030840
H 4.982727 -1.146457 1.826299
H -2.832663 3.180358 1.520362
H -4.238456 2.075532 -2.395370
H -4.110665 3.732755 -0.544676
H -0.321498 3.008712 -0.003097
H 0.211154 3.099090 -1.682036
H 0.539804 4.446484 -0.578132
H 4.271775 -3.777412 0.319952
H 4.034162 -3.524255 2.055976
H 5.672371 -3.577200 1.384128


%chk=000271672-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000271672

0 1
O 2.153016 1.200766 -0.811668
O 3.464346 -1.302037 0.709424
O 1.323940 1.040570 1.358171
O 2.831234 -2.605664 -1.112528
N -1.510503 -0.439038 -0.110848
C 1.239414 -0.938966 -0.160348
C 0.403372 -1.615805 0.971666
C 0.458830 -1.026196 -1.515932
C -0.962217 -0.909309 1.175662
C -1.057071 -1.218227 -1.276259
C 1.548961 0.520149 0.243423
C 2.577573 -1.705926 -0.281377
C -2.606171 0.442403 -0.137919
C -3.264396 0.824810 1.073927
C -3.087865 1.014252 -1.358288
C 2.506384 2.634274 -0.564739
C 4.784062 -2.008888 0.768762
C -4.341128 1.735249 1.057907
C -4.170868 1.914697 -1.358482
C -4.812102 2.289161 -0.153679
C 1.307037 3.541599 -0.851738
C 4.669713 -3.299584 1.583513
H 0.259256 -2.677823 0.698773
H 0.959549 -1.582573 1.923551
H 0.648005 -0.109376 -2.096851
H 0.856905 -1.879540 -2.094350
H -1.659261 -1.614716 1.685425
H -0.813798 -0.038291 1.836776
H -1.619248 -0.925798 -2.174902
H -1.278943 -2.295494 -1.109840
H -2.945325 0.403296 2.031077
H -2.602727 0.779420 -2.311149
H 2.846451 2.732986 0.481070
H 3.342845 2.815734 -1.258434
H 5.118154 -2.209452 -0.264235
H 5.445695 -1.270757 1.248781
H -4.821733 2.004361 2.006128
H -4.510043 2.335965 -2.312528
H -5.652190 2.991168 -0.160992
H 0.480287 3.334872 -0.151958
H 0.942660 3.400963 -1.884021
H 1.604406 4.600063 -0.731632
H 4.014690 -4.028009 1.076919
H 4.269845 -3.094045 2.591418
H 5.670164 -3.756944 1.696323


