%chk=000201764.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000201764

0 1
O 3.023553 -1.284052 2.047884
O -5.325832 -1.276977 -1.311177
O -6.614345 -0.348612 0.452822
N -0.415864 0.481557 -0.482242
N 2.013284 -1.018838 0.020458
C -0.250349 -0.283749 0.798049
C 0.910170 0.995592 -0.962436
C 0.705526 -1.471815 0.571868
C 1.853837 -0.202149 -1.208747
C -1.377708 1.621156 -0.305590
C -2.773298 1.102025 -0.047832
C 3.092430 -0.851583 0.908671
C -3.294921 0.091511 -0.899605
C -3.532109 1.641470 0.991877
C 4.339239 -0.230285 0.350124
C -4.581857 -0.314695 -0.639557
C -5.356587 0.243185 0.421800
C -4.857740 1.220335 1.251705
C 4.712545 1.051568 0.771887
C 5.145073 -0.950145 -0.540708
C -6.627561 -1.324817 -0.639552
C 5.893963 1.620143 0.286595
C 6.326624 -0.376618 -1.019228
C 6.699240 0.907798 -0.608428
H -1.250447 -0.671872 1.096321
H 0.115877 0.344501 1.637988
H 1.382654 1.714507 -0.259883
H 0.747308 1.533051 -1.921753
H 0.874690 -2.015618 1.531154
H 0.263118 -2.193010 -0.151681
H 1.424683 -0.862680 -1.999556
H 2.837353 0.154532 -1.580412
H -1.394818 2.205752 -1.257200
H -1.065900 2.331495 0.492362
H -2.688429 -0.336022 -1.696859
H -3.107953 2.412116 1.634249
H -5.440825 1.647332 2.061921
H 4.092616 1.595697 1.483960
H 4.854020 -1.953831 -0.851650
H -6.742220 -2.323429 -0.198178
H -7.391317 -1.011122 -1.362963
H 6.190511 2.615958 0.612511
H 6.959496 -0.933424 -1.708764
H 7.621170 1.351766 -0.981907


%chk=000201764-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000201764

0 1
O 3.193554 -0.860462 2.225262
O -5.136583 -1.794930 -1.157547
O -6.753771 -0.730556 0.260087
N -0.510538 0.737210 -0.310150
N 2.020379 -0.535341 0.236036
C -0.268909 0.080533 1.000216
C 0.747694 1.297155 -0.854140
C 0.770591 -1.044196 0.847026
C 1.804772 0.184815 -1.037363
C -1.608034 1.733312 -0.264361
C -2.979881 1.097090 -0.061253
C 3.193666 -0.534220 0.992091
C -3.307512 -0.099483 -0.766243
C -3.937738 1.713320 0.779494
C 4.492782 -0.183277 0.306164
C -4.593590 -0.608394 -0.596025
C -5.547424 0.017196 0.237492
C -5.248220 1.181795 0.945406
C 5.434956 0.597586 1.022937
C 4.852474 -0.712391 -0.960878
C -6.573866 -1.779409 -0.778804
C 6.700198 0.879325 0.465537
C 6.126491 -0.446703 -1.509881
C 7.049306 0.359464 -0.803787
H -1.220060 -0.347193 1.362920
H 0.091110 0.815323 1.763391
H 1.174709 2.090089 -0.187104
H 0.539431 1.757657 -1.838401
H 1.027244 -1.471501 1.829345
H 0.355623 -1.834842 0.191964
H 1.444145 -0.527711 -1.806037
H 2.750471 0.629914 -1.381093
H -1.594085 2.271352 -1.234255
H -1.443023 2.505581 0.529202
H -2.558256 -0.588484 -1.393984
H -3.665836 2.626411 1.321388
H -5.982973 1.655746 1.600954
H 5.166524 0.958031 2.021364
H 4.150964 -1.359148 -1.500470
H -6.843141 -2.757292 -0.350775
H -7.178405 -1.514313 -1.667054
H 7.417438 1.492003 1.022786
H 6.400459 -0.873261 -2.481190
H 8.035766 0.569903 -1.231970


