%chk=000209018.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000209018

0 1
I 0.515435 3.194319 0.475897
I -0.021843 -2.685533 -0.837659
I -4.990141 0.562236 0.133762
O 1.241197 0.564168 -0.072363
O 3.057287 -2.407263 0.958363
O 1.619427 -1.173223 2.156864
O -3.385921 -2.758458 0.399377
O -3.069808 3.260791 1.742665
N -3.509064 -2.180027 -1.816281
N -3.111163 3.738236 -0.500056
C 4.759750 -0.398311 -0.605186
C 3.538977 0.408725 -0.154240
C 6.040758 0.439340 -0.510279
C 2.275521 -0.461726 -0.131639
C 7.266633 -0.361489 -0.972003
C 2.218944 -1.324054 1.126401
C -0.103583 0.323847 -0.085192
C 8.546898 0.464819 -0.876971
C -0.763716 1.555383 0.180785
C -0.856048 -0.823553 -0.349776
C -2.141465 1.628326 0.239659
C -2.259304 -0.743543 -0.286990
C -2.892176 0.462239 0.004023
C -3.099832 -1.996369 -0.501145
C -2.820698 2.940292 0.598910
C -4.350504 -3.336533 -2.182770
C -3.773612 5.045668 -0.321332
H 4.618342 -0.756501 -1.643533
H 4.857485 -1.314782 0.016790
H 3.362581 1.271271 -0.834294
H 3.708030 0.866990 0.842343
H 5.941672 1.357665 -1.120739
H 6.191889 0.785779 0.530825
H 2.155946 -1.068469 -1.059551
H 7.368724 -1.279847 -0.360600
H 7.121550 -0.707043 -2.014342
H 9.416846 -0.114007 -1.207741
H 8.495994 1.364396 -1.500872
H 8.743083 0.790306 0.151204
H 3.060174 -3.009220 1.752251
H -3.272801 -1.529942 -2.554114
H -2.893678 3.458035 -1.447253
H -3.847768 -3.956772 -2.942824
H -5.326482 -3.001350 -2.571320
H -4.541278 -3.974576 -1.294850
H -4.748909 5.062065 -0.835261
H -3.140246 5.858740 -0.712810
H -3.954704 5.245254 0.755365


%chk=000209018-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000209018

0 1
I 0.456140 3.281388 0.026233
I -0.058736 -2.461094 -2.079184
I -4.896691 0.257361 0.599299
O 1.252842 0.439523 -1.123358
O 2.354253 -1.777834 1.497740
O 1.678630 0.425098 1.824680
O -3.075758 -3.030795 0.112799
O -2.754432 2.832369 2.112320
N -3.760708 -2.206215 -1.963874
N -3.211709 3.641958 -0.031094
C 4.892647 -0.423517 -0.355619
C 3.628545 0.367304 -0.760433
C 6.189141 0.320009 -0.749407
C 2.312666 -0.371018 -0.447077
C 7.471035 -0.458764 -0.376251
C 2.061879 -0.480991 1.060204
C -0.088628 0.341506 -0.734500
C 8.762749 0.291697 -0.766356
C -0.712920 1.499234 -0.189062
C -0.891900 -0.802196 -0.986095
C -2.078915 1.493072 0.184051
C -2.256883 -0.847246 -0.604667
C -2.828674 0.305408 -0.011746
C -3.065979 -2.128727 -0.774290
C -2.705904 2.711464 0.854633
C -4.596939 -3.360088 -2.313548
C -3.824889 4.897628 0.416451
H 4.879643 -1.421619 -0.839750
H 4.897004 -0.608524 0.737005
H 3.633548 0.546415 -1.852705
H 3.604293 1.355982 -0.265550
H 6.185302 0.514784 -1.842275
H 6.207650 1.313754 -0.255682
H 2.324886 -1.387822 -0.874862
H 7.472567 -0.657484 0.714887
H 7.452809 -1.450315 -0.872895
H 9.664738 -0.284719 -0.490442
H 8.800300 0.476649 -1.856618
H 8.819804 1.272653 -0.258039
H 2.210050 -1.840090 2.481828
H -3.687685 -1.426524 -2.619737
H -3.105691 3.468083 -1.032003
H -4.241417 -3.838878 -3.244135
H -5.654042 -3.061743 -2.438750
H -4.526690 -4.085378 -1.487625
H -4.850806 5.000515 0.019202
H -3.222765 5.770009 0.100884
H -3.865963 4.874017 1.516911


