%chk=000229657.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229657

0 1
O -1.754517 0.716449 -0.465770
O -2.961264 -0.584010 0.935394
C 1.420701 -1.355548 -0.107854
C 2.346553 -0.146621 -0.396266
C 1.880010 1.145513 0.300743
C -0.040331 -0.994424 -0.477441
C -0.488832 0.306985 0.183329
C 0.434703 1.488550 -0.109691
C 1.868362 -2.544911 -0.981599
C 1.510009 -1.764837 1.372791
C 2.818325 2.309848 -0.034779
C -2.929899 0.189559 0.006062
C -4.066595 0.728657 -0.793501
H 2.398219 0.021473 -1.488391
H 3.378081 -0.386597 -0.081186
H 1.904310 0.982085 1.407623
H -0.723495 -1.815341 -0.185370
H -0.138354 -0.899515 -1.576228
H -0.693401 0.177555 1.267786
H 0.080347 2.391634 0.419827
H 0.384780 1.741225 -1.187567
H 2.897939 -2.840819 -0.756186
H 1.822140 -2.307453 -2.048825
H 1.235351 -3.422785 -0.814237
H 1.227185 -0.944502 2.040624
H 2.525613 -2.069862 1.643553
H 0.844878 -2.606092 1.596316
H 2.840955 2.519508 -1.109880
H 2.509040 3.231043 0.470923
H 3.846248 2.095209 0.277397
H -3.971097 0.462249 -1.857382
H -4.105024 1.827986 -0.747673
H -5.026437 0.335688 -0.425738


%chk=000229657-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000229657

0 1
O -1.808197 0.750735 -0.533277
O -2.938804 -0.586548 1.014851
C 1.425080 -1.360028 -0.114813
C 2.387442 -0.154068 -0.339394
C 1.907224 1.175962 0.296476
C -0.009475 -0.956203 -0.576469
C -0.487275 0.354297 0.072352
C 0.475083 1.516415 -0.195195
C 1.904199 -2.558568 -0.973750
C 1.420355 -1.794468 1.376993
C 2.884921 2.329428 -0.017245
C -2.958222 0.196647 0.036654
C -4.193016 0.684890 -0.692240
H 2.504478 0.006604 -1.432994
H 3.392068 -0.412298 0.052891
H 1.874284 1.049026 1.399438
H -0.721255 -1.769726 -0.341602
H -0.008879 -0.814224 -1.676345
H -0.658272 0.209757 1.155317
H 0.103931 2.433790 0.299582
H 0.500345 1.717484 -1.285584
H 2.923666 -2.872378 -0.679072
H 1.926833 -2.295510 -2.048411
H 1.233426 -3.429912 -0.850666
H 1.088530 -0.988620 2.054999
H 2.435387 -2.101939 1.692397
H 0.741351 -2.654077 1.528731
H 2.952266 2.500209 -1.109042
H 2.556040 3.275224 0.452374
H 3.902469 2.102563 0.351871
H -4.150738 0.381872 -1.752864
H -4.237889 1.787351 -0.668112
H -5.092852 0.264212 -0.221048


