%chk=000201546.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000201546

0 1
O 0.647925 1.819194 0.139501
O -1.354340 -0.274893 0.247736
O 3.341261 1.002428 -0.468258
N -3.998722 1.130935 -0.642424
C 0.288508 -1.853296 -0.286035
C -0.031093 -0.494645 -0.031547
C 0.980084 0.482916 -0.092341
C 2.297713 0.096578 -0.414051
C -0.782750 -2.906532 -0.218340
C 1.610673 -2.198244 -0.584315
C 1.798992 2.625491 0.512087
C 2.625326 -1.240230 -0.655072
C 2.923862 2.396586 -0.492703
C -1.797619 1.104482 0.482079
C -3.306300 0.943341 0.669835
C -0.725051 -3.680930 1.098439
C -5.456446 0.845282 -0.535123
H -1.784254 -2.435175 -0.329688
H -0.682658 -3.602747 -1.075547
H 1.856821 -3.244766 -0.770346
H 2.094274 2.351266 1.540560
H 1.385284 3.648420 0.482468
H 2.611311 2.627678 -1.527496
H 3.859340 2.925282 -0.239744
H 3.649729 -1.512632 -0.892996
H -1.289873 1.477973 1.386742
H -1.519136 1.724320 -0.391137
H -3.511861 -0.044274 1.145329
H -3.679714 1.723722 1.370224
H 0.239959 -4.183222 1.229255
H -1.509284 -4.443398 1.145180
H -0.860616 -3.009592 1.955637
H -3.581868 0.492783 -1.333419
H -5.923578 1.562338 0.159703
H -5.709661 -0.171597 -0.200457
H -5.916837 1.009557 -1.523735


%chk=000201546-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000201546

0 1
O 0.910363 1.839466 0.581083
O -1.236516 0.007261 0.353454
O 3.581642 0.982479 -0.252798
N -4.041253 0.052548 -0.203734
C 0.256867 -1.673651 -0.555367
C 0.058100 -0.351161 -0.074604
C 1.153435 0.545988 0.047252
C 2.454285 0.126574 -0.339920
C -0.911780 -2.641272 -0.654491
C 1.572850 -2.070458 -0.903339
C 2.146757 2.508736 1.039821
C 2.664970 -1.185055 -0.807061
C 3.226278 2.399718 -0.040340
C -1.861005 1.209310 -0.275000
C -3.299637 1.249807 0.231612
C -1.316073 -3.238382 0.720079
C -5.445363 0.008196 0.238791
H -1.787631 -2.123086 -1.089055
H -0.643175 -3.462280 -1.346058
H 1.738011 -3.088600 -1.273268
H 2.490769 2.034463 1.979304
H 1.861761 3.555916 1.229518
H 2.862691 2.835627 -0.991581
H 4.160875 2.897228 0.265259
H 3.677037 -1.483864 -1.095071
H -1.299737 2.112759 0.020645
H -1.838933 1.084341 -1.375131
H -3.284645 1.378191 1.343523
H -3.789343 2.149887 -0.192515
H -0.471760 -3.787193 1.175573
H -2.163261 -3.941084 0.610487
H -1.615227 -2.434595 1.415307
H -3.518455 -0.795013 0.053142
H -6.011375 0.835044 -0.231048
H -5.583788 0.095726 1.345386
H -5.908334 -0.939170 -0.089855


