%chk=000186530.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186530

0 1
O -2.172968 3.108439 -0.166295
O -3.920733 1.672814 -1.455990
O -1.100548 -3.642254 -0.902047
O -2.157263 -3.380865 0.960335
N -1.451347 -2.970483 0.053206
C -1.491419 0.809724 0.343298
C 0.827049 0.056673 0.075989
C -0.112721 1.110548 0.277268
C -2.534021 1.905094 0.507483
C -1.926278 -0.530274 0.324030
C 0.388991 -1.293528 -0.037608
C 2.240038 0.355475 -0.016259
C -3.940088 1.506366 -0.029151
C -0.987800 -1.564059 0.116744
C 2.701135 1.694208 0.118264
C 3.183726 -0.684955 -0.240083
C 0.400894 2.462517 0.424625
C -3.358571 -0.830165 0.510401
C -4.304575 0.101807 0.349709
C 1.375966 -2.330676 -0.283088
C 1.723921 2.739832 0.351107
C 2.696154 -2.043828 -0.378217
C 4.074947 1.970889 0.028244
C 4.551749 -0.379627 -0.326299
C 4.989798 0.939388 -0.192553
H -2.582766 2.213277 1.581133
H -4.700542 2.260217 0.286319
H -0.324666 3.270089 0.595384
H -3.622478 -1.851933 0.814995
H -5.366996 -0.109815 0.464406
H 1.028432 -3.361014 -0.413761
H 2.091583 3.761133 0.466795
H 3.430268 -2.830596 -0.565272
H 4.428633 2.996836 0.131189
H 5.275251 -1.176507 -0.498737
H -2.389260 3.036232 -1.137810
H 6.054147 1.165569 -0.261122
H -3.479943 0.905951 -1.889533


%chk=000186530-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000186530

0 1
O -2.255951 3.211662 -0.117784
O -4.103162 1.832407 -1.418296
O -1.091793 -3.714264 -0.936091
O -2.138153 -3.405313 1.064723
N -1.426814 -2.974972 0.071590
C -1.491013 0.824476 0.284124
C 0.869338 0.050897 0.034977
C -0.091813 1.124795 0.211734
C -2.554068 1.921383 0.515402
C -1.929953 -0.535470 0.274563
C 0.428143 -1.321243 -0.059262
C 2.278516 0.342825 -0.031678
C -3.985033 1.536092 0.051620
C -0.965910 -1.569244 0.094820
C 2.748115 1.699860 0.089242
C 3.238902 -0.717224 -0.211701
C 0.421315 2.477443 0.343327
C -3.368780 -0.848786 0.409387
C -4.339528 0.105231 0.330497
C 1.411772 -2.368704 -0.241568
C 1.775871 2.746399 0.286459
C 2.759166 -2.073257 -0.313076
C 4.141306 1.970430 0.020142
C 4.624575 -0.407444 -0.278618
C 5.070781 0.925457 -0.164620
H -2.591914 2.127534 1.603961
H -4.694476 2.246361 0.503661
H -0.297869 3.288223 0.460771
H -3.655489 -1.890298 0.569828
H -5.398195 -0.164653 0.398801
H 1.079972 -3.404337 -0.336507
H 2.132151 3.777993 0.390874
H 3.489101 -2.879048 -0.451024
H 4.487949 3.006061 0.112486
H 5.346223 -1.220437 -0.418443
H -2.696555 3.169123 -1.015180
H 6.141328 1.149274 -0.217514
H -3.830355 1.023266 -1.924527


