%chk=000294430.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000294430

0 1
O 3.096924 0.369247 0.333990
O -2.830798 -0.383171 -0.520752
O 1.269034 0.045775 -3.123698
O -0.550383 3.317483 -0.346699
O 1.270244 1.502704 2.430770
O -4.080071 1.017364 1.794183
N 0.774647 -3.699595 0.586447
C -0.070501 0.342895 -0.742954
C 1.239253 1.132143 -0.994974
C -1.052240 1.058684 0.218646
C 0.236589 -1.063217 -0.254049
C 2.160022 1.122583 0.216750
C -2.308561 0.206768 0.392706
C 1.910429 0.636634 -2.285380
C -1.415944 2.471024 -0.251943
C 0.317225 -2.107163 -1.185525
C 0.440630 -1.352667 1.102038
C 1.850825 2.164687 1.298576
C -2.905810 0.193184 1.803560
C 3.351787 0.980915 -2.466822
C -2.846389 2.755672 -0.548560
C 0.586422 -3.406191 -0.726902
C 0.706644 -2.677815 1.478870
C 2.235934 0.848232 3.288266
C -5.253700 0.370654 1.249168
H -0.595132 0.256864 -1.742898
H 0.959263 2.210223 -1.208437
H -0.538387 1.177557 1.218739
H 0.184356 -1.912004 -2.252974
H 0.419789 -0.560703 1.851812
H 2.762785 2.721687 1.576614
H 1.059990 2.892193 1.004170
H -3.129067 -0.838750 2.129418
H -2.271328 0.686058 2.564636
H 3.572157 2.038631 -2.285295
H 3.695421 0.737302 -3.484249
H 3.981861 0.394099 -1.769725
H -3.233333 2.123726 -1.364915
H -3.000262 3.804531 -0.845490
H -3.500401 2.567796 0.328159
H 0.655920 -4.250178 -1.423698
H 0.874580 -2.945900 2.527898
H 1.599999 0.350459 4.028303
H 2.877150 1.595308 3.764293
H 2.830454 0.123361 2.717174
H -5.987936 1.184722 1.243238
H -5.574010 -0.439970 1.909632
H -5.059675 0.000461 0.234986


%chk=000294430-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000294430

0 1
O 3.169543 0.352435 0.270422
O -2.825786 -0.586512 -0.264948
O 1.117624 0.175259 -3.130991
O -0.838128 3.437835 0.189437
O 1.519641 1.416600 2.607547
O -4.256900 1.210232 1.731619
N 0.793175 -3.811901 0.607828
C -0.115076 0.320109 -0.609226
C 1.178172 1.180667 -0.897733
C -1.098936 1.023144 0.396120
C 0.213005 -1.110746 -0.164767
C 2.204400 1.164636 0.249631
C -2.347372 0.160540 0.632746
C 1.790620 0.812815 -2.280361
C -1.505352 2.424325 -0.154936
C 0.245516 -2.158240 -1.116811
C 0.478546 -1.450982 1.185213
C 2.000405 2.149321 1.419105
C -3.088076 0.338009 1.966759
C 3.185711 1.318883 -2.592441
C -2.668147 2.518119 -1.119593
C 0.536932 -3.473618 -0.691669
C 0.759791 -2.794114 1.518757
C 2.584843 0.700600 3.333140
C -5.408754 0.503401 1.145738
H -0.625537 0.238974 -1.587282
H 0.851519 2.237845 -1.008049
H -0.590883 1.204732 1.360097
H 0.044361 -1.950756 -2.171887
H 0.483829 -0.686618 1.970276
H 2.964929 2.651275 1.642983
H 1.217687 2.892721 1.200114
H -3.403610 -0.651390 2.357081
H -2.478992 0.868653 2.715930
H 3.353607 2.334565 -2.189545
H 3.351194 1.307320 -3.680632
H 3.922857 0.654307 -2.104312
H -2.672665 1.682132 -1.840358
H -2.647742 3.485888 -1.643119
H -3.607175 2.444911 -0.536124
H 0.562279 -4.299030 -1.411959
H 0.968943 -3.079064 2.556606
H 2.098783 0.279734 4.227647
H 3.384060 1.406119 3.636574
H 3.025080 -0.105597 2.717921
H -6.211695 1.254726 1.086527
H -5.723234 -0.335360 1.799133
H -5.176591 0.107399 0.138895


