%chk=000269243.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000269243

0 1
O 0.590315 -3.222373 0.247999
N 1.725327 -0.019624 -0.605502
N 1.946063 -1.437201 -0.436918
C 2.849131 0.660041 0.182866
C 3.208059 -1.561363 0.403428
C 3.034760 -0.339551 1.378806
C 4.105233 0.317329 -0.634508
C 4.318407 -1.006000 -0.504236
C 0.340430 0.236228 -0.264123
C 0.680119 -2.049177 -0.001588
C -0.321239 -0.939801 -0.028908
C -0.144316 1.618864 -0.300123
C -1.742972 -1.180707 0.180304
C -0.990268 2.086901 0.720092
C 0.238418 2.477253 -1.344076
C -2.704731 -0.386845 -0.471078
C -2.166741 -2.220787 1.028284
C -1.441161 3.408060 0.695791
C -0.221899 3.796118 -1.362684
C -4.065144 -0.618809 -0.258510
C -3.528829 -2.444606 1.235583
C -1.058171 4.263147 -0.343620
C -4.481354 -1.642865 0.598015
H 2.643220 1.712633 0.400056
H 3.332929 -2.565924 0.824276
H 3.920748 -0.135230 1.991120
H 2.178927 -0.411098 2.058899
H 4.636280 1.054417 -1.201328
H 5.068336 -1.636359 -0.938502
H -1.300423 1.414059 1.521327
H 0.886354 2.107310 -2.141445
H -2.388682 0.403328 -1.150736
H -1.428303 -2.866670 1.507210
H -2.096915 3.771271 1.486391
H 0.070146 4.460182 -2.175404
H -4.804025 -0.001481 -0.766640
H -3.849241 -3.251657 1.892751
H -1.414698 5.292371 -0.360507
H -5.541690 -1.820483 0.761737


%chk=000269243-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000269243

0 1
O 0.614068 -3.228049 0.615199
N 1.674542 -0.007213 -0.451043
N 1.899287 -1.415722 -0.234982
C 2.909323 0.681504 0.135977
C 3.260634 -1.524224 0.411528
C 3.203445 -0.265900 1.350068
C 4.057736 0.293129 -0.813650
C 4.268203 -1.043915 -0.647192
C 0.318764 0.249952 -0.173804
C 0.686234 -2.021950 0.233726
C -0.344458 -0.956726 0.114998
C -0.151755 1.648346 -0.241649
C -1.789755 -1.220588 0.242988
C -1.086779 2.145657 0.707780
C 0.364443 2.534698 -1.227809
C -2.756975 -0.447978 -0.464365
C -2.251456 -2.296651 1.056573
C -1.496788 3.493721 0.666032
C -0.048776 3.883890 -1.265927
C -4.134098 -0.720704 -0.338170
C -3.631197 -2.567123 1.176956
C -0.980530 4.369523 -0.319377
C -4.581849 -1.778996 0.488285
H 2.712792 1.743770 0.320695
H 3.384016 -2.519715 0.853253
H 4.159225 -0.043189 1.846019
H 2.380503 -0.310065 2.084234
H 4.520521 0.963968 -1.539415
H 4.937387 -1.696601 -1.210109
H -1.486574 1.471986 1.472325
H 1.064487 2.149097 -1.977917
H -2.426702 0.356494 -1.129601
H -1.517820 -2.923086 1.571619
H -2.217436 3.862725 1.404012
H 0.348291 4.552105 -2.038082
H -4.858675 -0.115462 -0.895135
H -3.963655 -3.399730 1.807461
H -1.303590 5.415890 -0.350097
H -5.652631 -1.991968 0.583094


