%chk=000254440.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000254440

0 1
O 3.359753 -2.252463 -0.296862
O 3.435880 2.041599 1.435639
O -3.444538 2.070621 -1.378474
O -3.352444 -2.272473 0.226306
N 3.064783 -0.143010 0.680680
N -3.065354 -0.133972 -0.688447
C 0.739286 -0.189042 -0.203072
C -0.739669 -0.197872 0.193641
C 1.632613 -0.257886 1.045451
C -1.632806 -0.232810 -1.056430
C 3.806466 -1.178457 0.007989
C 3.847446 1.047146 0.898949
C -3.852438 1.059204 -0.871513
C -3.803180 -1.191621 -0.046778
C 5.179917 -0.598428 -0.190022
C 5.203335 0.723382 0.337029
C -5.207135 0.713881 -0.319654
C -5.178814 -0.622853 0.168052
C 6.298755 -1.156655 -0.768260
C 6.345358 1.492327 0.287482
C -6.352033 1.476747 -0.247581
C -6.295602 -1.202131 0.729295
C 7.474065 -0.368923 -0.821506
C 7.496723 0.921970 -0.307234
C -7.501302 0.884739 0.329778
C -7.473855 -0.420718 0.805614
H 0.973061 0.722245 -0.788676
H 0.967113 -1.048622 -0.868028
H -0.964101 -1.077875 0.832531
H -0.976963 0.694552 0.806251
H 1.480243 -1.223974 1.579861
H 1.387436 0.566830 1.755686
H -1.390654 0.613500 -1.741858
H -1.476989 -1.182050 -1.619272
H 6.285201 -2.169650 -1.172560
H 6.367317 2.505627 0.690613
H -6.377754 2.501448 -0.620547
H -6.278292 -2.226596 1.103425
H 8.371626 -0.791597 -1.275875
H 8.412005 1.513937 -0.357604
H -8.418794 1.471534 0.397479
H -8.369864 -0.860009 1.247102


%chk=000254440-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000254440

0 1
O 3.431525 -2.354086 0.538157
O 3.426865 2.354821 0.602300
O -3.435360 2.357456 -0.535368
O -3.425308 -2.351247 -0.612618
N 3.095460 -0.001213 0.660481
N -3.096577 0.005314 -0.664151
C 0.742577 0.006576 -0.210248
C -0.743679 -0.001838 0.206579
C 1.671577 -0.007703 1.025946
C -1.672695 0.014259 -1.029581
C 3.865315 -1.179928 0.432414
C 3.863012 1.184819 0.464904
C -3.867792 1.182498 -0.432868
C -3.862781 -1.182147 -0.471898
C 5.237533 -0.699353 0.065813
C 5.236165 0.717099 0.085273
C -5.239511 0.699332 -0.067774
C -5.236493 -0.717057 -0.091094
C 6.393137 -1.425808 -0.256551
C 6.390395 1.454306 -0.216994
C -6.396022 1.423533 0.256429
C -6.389872 -1.456456 0.209037
C 7.566828 -0.689178 -0.565441
C 7.565486 0.728657 -0.545945
C -7.568869 0.684673 0.563203
C -7.565854 -0.733100 0.539839
H 0.959755 0.908516 -0.814596
H 0.963275 -0.878496 -0.837790
H -0.961004 -0.904554 0.809707
H -0.964211 0.882431 0.835321
H 1.487600 -0.915615 1.628149
H 1.485268 0.884343 1.650711
H -1.489693 0.923745 -1.629704
H -1.485433 -0.876148 -1.656392
H 6.382407 -2.520172 -0.266988
H 6.377598 2.548519 -0.197433
H -6.386585 2.517876 0.269883
H -6.375789 -2.550596 0.186436
H 8.488670 -1.221725 -0.822715
H 8.486304 1.269824 -0.788475
H -8.491358 1.215432 0.821845
H -8.486062 -1.276007 0.780794


