%chk=000255762.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000255762

0 1
O -1.833251 2.066904 0.912452
O -5.721772 0.163608 2.516875
N -1.221250 -0.692412 -0.385544
N -2.727234 -2.412950 -0.206650
N -4.389986 -1.187875 1.215345
N -3.764740 1.114681 1.721050
N 4.194588 1.728287 -1.154063
N 2.544781 1.464650 0.418129
C 2.683733 -3.685637 0.294023
C 4.050283 -2.987975 0.361073
C 1.684808 -2.899729 -0.568141
C 3.975739 -1.644562 1.097802
C 0.369671 -3.663195 -0.747925
C 5.172867 -0.740495 0.775764
C -0.654728 -2.873407 -1.579144
C 4.871814 0.733866 1.091974
C -1.518251 -2.008949 -0.729622
C -2.295868 -0.223756 0.394515
C -3.205764 -1.312082 0.494578
C 3.854293 1.299555 0.162945
C -2.527478 1.072123 0.983793
C -4.698981 0.046806 1.867963
C 3.003156 2.192124 -1.746928
C 1.980143 2.030085 -0.746574
C -5.329351 -2.330919 1.314385
C -4.134098 2.393717 2.389199
C 2.717493 2.723972 -3.014626
C 0.660555 2.432018 -1.018205
C 1.403272 3.094313 -3.257377
C 0.391557 2.954049 -2.272884
H 2.276708 -3.818541 1.315345
H 2.815058 -4.706596 -0.113593
H 4.780219 -3.651736 0.862719
H 4.437728 -2.840424 -0.666110
H 1.495810 -1.911352 -0.099573
H 2.134989 -2.681660 -1.556109
H 3.029389 -1.124275 0.829203
H 3.906062 -1.811024 2.189147
H -0.064976 -3.923134 0.239375
H 0.564525 -4.634245 -1.245703
H 6.058136 -1.066174 1.355482
H 5.455482 -0.843544 -0.289960
H -1.311709 -3.591583 -2.127352
H -0.149432 -2.278487 -2.368379
H 4.494085 0.825840 2.138560
H 5.804451 1.333432 1.062686
H -0.395894 -0.147877 -0.592316
H 5.096660 1.705260 -1.586717
H -6.201316 -2.054184 1.937584
H -4.824129 -3.201374 1.769828
H -5.683280 -2.621697 0.309263
H -3.232845 3.022226 2.520188
H -4.583291 2.196318 3.378906
H -4.865387 2.949182 1.778261
H 3.493217 2.842696 -3.763075
H -0.109993 2.355426 -0.240671
H 1.131625 3.513438 -4.225800
H -0.619989 3.279877 -2.514572


%chk=000255762-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000255762

0 1
O -2.113340 1.990345 -0.022619
O -5.239886 0.221713 3.038808
N -1.588342 -0.976291 -0.822220
N -2.714124 -2.695030 0.149654
N -4.070478 -1.305778 1.693500
N -3.674586 1.074212 1.514867
N 4.374797 2.075362 -0.844484
N 2.478510 1.595491 0.327140
C 2.467104 -3.816483 0.178010
C 3.776128 -2.989254 0.230513
C 1.326916 -3.114850 -0.599529
C 3.603135 -1.596535 0.876208
C 0.134119 -4.047891 -0.895510
C 4.902500 -0.761692 0.885400
C -1.035834 -3.337266 -1.638944
C 4.655677 0.723092 1.297118
C -1.775119 -2.352209 -0.781787
C -2.443944 -0.401431 0.124219
C -3.117769 -1.487457 0.702981
C 3.818058 1.470969 0.298336
C -2.679362 0.969297 0.480603
C -4.380574 0.003045 2.137779
C 3.325171 2.624277 -1.598377
C 2.138220 2.314299 -0.847033
C -4.763592 -2.464037 2.288921
C -4.024224 2.428952 2.001052
C 3.287039 3.336473 -2.814508
C 0.870522 2.727465 -1.319311
C 2.012613 3.736672 -3.273920
C 0.827846 3.437428 -2.539065
H 2.122888 -4.036281 1.209696
H 2.679405 -4.796580 -0.297161
H 4.550297 -3.562662 0.781130
H 4.159113 -2.859988 -0.804330
H 0.975578 -2.235843 -0.024824
H 1.731303 -2.724530 -1.558367
H 2.824334 -1.027294 0.336940
H 3.233113 -1.710539 1.916434
H -0.255319 -4.481117 0.046102
H 0.477386 -4.895754 -1.521270
H 5.635690 -1.206635 1.587559
H 5.368866 -0.792204 -0.121123
H -1.765398 -4.096537 -1.973348
H -0.644694 -2.831150 -2.542831
H 4.124583 0.747192 2.264979
H 5.626352 1.237931 1.438089
H -0.931505 -0.456070 -1.405479
H 5.367196 2.117102 -1.069449
H -5.471393 -2.079252 3.037296
H -4.032653 -3.137748 2.766781
H -5.301213 -3.025674 1.506789
H -3.411632 3.147124 1.436822
H -3.816921 2.508067 3.080633
H -5.097171 2.623282 1.840122
H 4.192620 3.574295 -3.383052
H -0.043215 2.512567 -0.754485
H 1.933168 4.293797 -4.214275
H -0.140055 3.774217 -2.926380


