%chk=000250256.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250256

0 1
O -4.195424 -0.283184 -1.016136
O 1.647027 2.794061 -1.095183
O 3.845139 -2.271856 -1.747152
O 4.873145 -0.388958 -1.113027
O -4.152362 -1.243858 1.030423
N 1.931440 0.948657 0.228110
C 2.844511 0.033792 0.964880
C 0.540811 0.573977 0.191877
C 3.025327 -1.303514 0.228802
C -0.013400 -0.136805 1.280526
C -0.268797 0.891043 -0.916963
C 2.419593 2.110684 -0.454159
C -2.153898 -0.208814 0.143170
C -1.350132 -0.520453 1.252523
C -1.605989 0.504669 -0.934956
C 3.870747 2.442265 -0.317089
C 4.009354 -1.208262 -0.895104
C -3.565843 -0.642082 0.156649
C -5.616177 -0.605781 -1.152277
C -6.445653 0.398444 -0.379777
H 2.427976 -0.162478 1.983567
H 3.835772 0.516027 1.126823
H 2.046509 -1.683289 -0.155681
H 3.363216 -2.092371 0.938842
H 0.590312 -0.369696 2.156383
H 0.139411 1.462176 -1.757997
H -1.787303 -1.065501 2.095346
H -2.238646 0.752935 -1.793572
H 4.530466 1.644508 -0.713785
H 4.170835 2.645572 0.718344
H 4.100312 3.350506 -0.901333
H -5.740802 -0.526484 -2.247522
H -5.776349 -1.643653 -0.809378
H -6.164845 1.429966 -0.628799
H -6.303808 0.277867 0.705150
H -7.515314 0.281535 -0.587518
H 4.482839 -2.257547 -2.513409


%chk=000250256-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000250256

0 1
O -4.189575 -0.267885 -1.068999
O 1.665477 3.051518 -0.844264
O 3.426046 -2.521132 -1.713114
O 4.528565 -0.498888 -1.439033
O -4.050747 -1.347280 0.999041
N 2.026348 0.995807 0.231095
C 2.958282 0.085102 0.947043
C 0.635521 0.614234 0.180638
C 3.009834 -1.329842 0.333729
C 0.063302 -0.133865 1.248595
C -0.181343 0.939073 -0.939035
C 2.469192 2.240584 -0.301038
C -2.093016 -0.213082 0.086932
C -1.281511 -0.539484 1.201632
C -1.526116 0.530790 -0.979771
C 3.955278 2.573588 -0.193444
C 3.732343 -1.359977 -1.001065
C -3.509392 -0.669948 0.086525
C -5.629081 -0.657310 -1.157348
C -6.514550 0.371714 -0.448142
H 2.674434 0.006670 2.012867
H 3.964871 0.520692 0.916210
H 2.002829 -1.762341 0.210168
H 3.556358 -2.007259 1.020060
H 0.655626 -0.388066 2.132689
H 0.235615 1.519126 -1.761886
H -1.724592 -1.108137 2.025750
H -2.147777 0.780372 -1.843782
H 4.578989 1.806482 -0.685703
H 4.284862 2.680108 0.856825
H 4.100502 3.539523 -0.698767
H -5.822223 -0.692543 -2.241591
H -5.749581 -1.661730 -0.714466
H -6.344607 1.383931 -0.854182
H -6.310710 0.381501 0.635625
H -7.579459 0.112736 -0.596945
H 3.930007 -2.530682 -2.572251


