%chk=000256346.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256346

0 1
O 3.008654 -0.053854 -0.042337
O -0.680089 -2.790176 -0.333771
O -3.127603 2.139160 0.137377
O 1.536747 1.680036 0.230578
N 0.831910 -0.554801 -0.037441
C 4.161380 0.877946 0.090079
C -0.578106 -0.397284 -0.039401
C -1.362567 -1.586210 -0.150955
C -1.222303 0.834211 0.053926
C 4.338159 1.201453 1.561623
C 5.289819 0.062039 -0.514439
C -2.632851 0.861071 0.031323
C -2.751883 -1.534264 -0.178885
C -3.406800 -0.300468 -0.086328
C 1.751216 0.498396 0.067418
C -0.651298 -3.624800 0.854582
C -4.564942 2.315780 0.107096
H 3.915407 1.782648 -0.509761
H -0.663054 1.773037 0.142268
H 5.252093 1.778676 1.741063
H 3.492274 1.798125 1.937228
H 4.391420 0.293714 2.175401
H 6.233573 0.618898 -0.501763
H 5.069526 -0.211787 -1.555218
H 5.446288 -0.878256 0.031483
H 1.188665 -1.509588 -0.200175
H -3.323134 -2.456918 -0.279789
H -4.489300 -0.263664 -0.111113
H -1.666076 -3.920811 1.131969
H -0.154287 -3.100240 1.674521
H -0.067108 -4.488209 0.516809
H -4.970917 1.969808 -0.847690
H -4.655865 3.406330 0.200816
H -5.028448 1.809302 0.958205


%chk=000256346-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000256346

0 1
O 3.116319 -0.051896 0.115026
O -0.454342 -2.699353 0.369381
O -3.177099 2.203923 -0.047750
O 1.636603 1.783245 -0.028487
N 0.897703 -0.459501 0.169682
C 4.286188 0.891148 0.070914
C -0.509308 -0.321204 0.161325
C -1.256338 -1.538591 0.270734
C -1.191003 0.905400 0.056180
C 4.547806 1.434755 1.483070
C 5.442276 0.069709 -0.504613
C -2.608622 0.921103 0.061251
C -2.659100 -1.510533 0.273388
C -3.350369 -0.276342 0.168804
C 1.842245 0.546429 0.078143
C -1.141231 -3.983455 0.486989
C -4.636318 2.291292 -0.044598
H 4.006487 1.721114 -0.604772
H -0.635701 1.840956 -0.029406
H 5.422287 2.111280 1.471272
H 3.676864 2.005225 1.846963
H 4.756732 0.607319 2.184478
H 6.343731 0.702272 -0.596693
H 5.185651 -0.322096 -1.503609
H 5.681188 -0.783298 0.154984
H 1.247571 -1.418956 0.249131
H -3.234353 -2.437409 0.356310
H -4.443464 -0.274707 0.173016
H -1.771173 -4.181511 -0.402021
H -1.765837 -4.019053 1.400721
H -0.343162 -4.737627 0.552271
H -5.077323 1.743959 -0.901444
H -4.860802 3.364244 -0.136726
H -5.063608 1.901458 0.900786


