%chk=000227781.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227781

0 1
O -1.293731 -3.857911 -1.871567
N -1.282696 -1.961909 0.271244
N 1.469464 1.652834 -0.515509
C -1.894379 0.155893 1.541465
C -0.777266 -0.895598 1.195695
C -2.061342 1.183100 0.426397
C 0.484302 -0.207303 0.716053
C -1.446075 0.931581 2.799635
C -3.200755 -0.589796 1.851363
C -0.940960 1.599235 -0.327989
C 0.390707 1.015600 -0.051950
C -1.483882 -1.517175 -1.144399
C -0.386100 -3.166924 0.292470
C 1.728405 -0.720463 0.990324
C -2.113797 -2.672496 -1.938980
C -1.065798 -4.285510 -0.514450
C -3.307338 1.766746 0.161776
C -1.091753 2.566508 -1.335058
C 2.900936 -0.062347 0.507115
C 2.728764 1.129000 -0.252134
C -3.450342 2.728467 -0.842378
C -2.343329 3.127726 -1.594921
C 4.223403 -0.544020 0.750797
C 3.877201 1.822056 -0.760048
C 5.307927 0.135985 0.254855
C 5.131817 1.329712 -0.507730
H -0.547365 -1.424066 2.165460
H -0.480732 1.429388 2.648669
H -2.171475 1.712109 3.057530
H -1.351702 0.275070 3.669664
H -3.970137 0.077569 2.250949
H -3.601997 -1.081218 0.954314
H -3.037617 -1.385344 2.587508
H -0.540204 -1.189610 -1.632582
H -2.175874 -0.647082 -1.153857
H -0.247261 -3.494267 1.343309
H 0.620669 -2.962244 -0.133767
H 1.848142 -1.630108 1.579231
H -3.125025 -2.919056 -1.570716
H -2.138708 -2.464687 -3.023054
H -0.408917 -5.162429 -0.647165
H -2.028177 -4.588119 -0.065443
H -4.181496 1.475549 0.743819
H -0.218588 2.884658 -1.912084
H -4.428000 3.167957 -1.035455
H -2.452297 3.876413 -2.377014
H 4.350312 -1.455353 1.333018
H 3.716560 2.732563 -1.339008
H 6.320686 -0.222464 0.433567
H 6.016721 1.841781 -0.885371


%chk=000227781-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000227781

0 1
O -1.297588 -3.984216 -1.853206
N -1.208248 -1.966909 0.234170
N 1.489117 1.681476 -0.544495
C -1.942383 0.134602 1.513328
C -0.793708 -0.881630 1.181129
C -2.087678 1.196612 0.405014
C 0.483955 -0.161288 0.741576
C -1.532220 0.887987 2.821569
C -3.252942 -0.641699 1.788737
C -0.931847 1.665441 -0.294268
C 0.398286 1.056252 -0.038791
C -1.441101 -1.588744 -1.186214
C -0.367959 -3.188499 0.306550
C 1.750528 -0.680945 1.013703
C -2.114755 -2.760435 -1.920791
C -1.062721 -4.338487 -0.444803
C -3.337934 1.794889 0.114645
C -1.052835 2.714276 -1.243027
C 2.928203 -0.045411 0.505065
C 2.741497 1.148501 -0.295768
C -3.453635 2.833035 -0.836282
C -2.303499 3.299079 -1.516143
C 4.254361 -0.526719 0.745400
C 3.889742 1.812526 -0.836183
C 5.357721 0.141227 0.206889
C 5.172871 1.317080 -0.589858
H -0.574348 -1.414658 2.129629
H -0.557529 1.395742 2.714178
H -2.287647 1.653791 3.071217
H -1.464040 0.178982 3.668590
H -4.014504 0.011523 2.252224
H -3.670152 -1.084111 0.869489
H -3.052895 -1.471391 2.490480
H -0.490526 -1.329260 -1.709276
H -2.103182 -0.708193 -1.231385
H -0.234659 -3.473710 1.368278
H 0.643841 -3.032829 -0.141378
H 1.853928 -1.584029 1.628689
H -3.113444 -2.955281 -1.472081
H -2.225931 -2.540221 -2.995405
H -0.427609 -5.240017 -0.468053
H -2.030518 -4.572681 0.049948
H -4.236861 1.449226 0.634170
H -0.142404 3.047627 -1.749831
H -4.434610 3.275558 -1.043766
H -2.385357 4.106367 -2.252074
H 4.393709 -1.428933 1.353533
H 3.721994 2.711664 -1.437090
H 6.370866 -0.232500 0.391133
H 6.047550 1.829334 -1.005564


