%chk=000245386.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245386

0 1
O -1.420683 1.751661 -1.738299
O 4.571097 -0.429284 0.240965
O 2.897065 -0.721742 1.734807
N -2.173010 -0.025072 -0.511756
C -3.409450 0.715859 -0.076595
C -1.958131 -1.404429 0.029561
C -1.213180 0.632915 -1.288843
C 0.105488 -0.076267 -1.574154
C -4.267825 1.063961 -1.296882
C -3.032240 1.969247 0.720864
C -3.224046 -2.256413 -0.120678
C -1.488505 -1.339422 1.487429
C 1.077887 0.144532 -0.413293
C 2.420401 -0.546691 -0.669188
C 3.245222 -0.578181 0.587107
C 5.539815 -0.457095 1.322853
H -3.992093 0.027595 0.594256
H -1.148035 -1.891047 -0.586743
H -0.047025 -1.156641 -1.770193
H 0.521166 0.349366 -2.513342
H -4.531148 0.174633 -1.876574
H -3.725638 1.744807 -1.974961
H -5.192633 1.567022 -1.001007
H -2.485634 2.688972 0.088656
H -3.922787 2.481165 1.096714
H -2.388865 1.733350 1.573464
H -3.027034 -3.298240 0.154921
H -4.043117 -1.900963 0.517668
H -3.592635 -2.247465 -1.153788
H -0.524107 -0.807684 1.567377
H -1.344879 -2.340487 1.907392
H -2.200918 -0.813002 2.131803
H 0.632257 -0.234165 0.540658
H 1.235751 1.232929 -0.257942
H 2.271914 -1.592506 -1.016892
H 2.976145 -0.041128 -1.489837
H 5.508915 -1.433071 1.816519
H 5.318946 0.344320 2.035098
H 6.487348 -0.290841 0.799758


%chk=000245386-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245386

0 1
O -1.388771 1.817871 -1.673144
O 4.805917 -0.478473 0.027873
O 3.163449 -0.673856 1.666751
N -2.171184 0.040613 -0.380588
C -3.457561 0.764862 -0.089661
C -1.999475 -1.312174 0.233006
C -1.214048 0.650353 -1.186063
C 0.109263 -0.079901 -1.476525
C -4.284283 1.014091 -1.373518
C -3.223524 2.063269 0.718645
C -3.044330 -2.322240 -0.303259
C -2.001937 -1.247787 1.780675
C 1.136770 0.077689 -0.325541
C 2.522654 -0.475475 -0.720119
C 3.477796 -0.546819 0.460898
C 5.835164 -0.592058 1.091153
H -4.038005 0.074388 0.550760
H -1.005906 -1.676286 -0.072580
H -0.035803 -1.151414 -1.715345
H 0.504978 0.406263 -2.385699
H -4.469475 0.067692 -1.913266
H -3.751383 1.706550 -2.043673
H -5.261581 1.457555 -1.106280
H -2.660573 2.792830 0.115941
H -4.196949 2.507244 0.999000
H -2.658530 1.855483 1.645229
H -2.835813 -3.330203 0.099739
H -4.071575 -2.048934 -0.001060
H -3.011618 -2.373552 -1.406037
H -1.234038 -0.543548 2.146210
H -1.782314 -2.247080 2.198816
H -2.982262 -0.927853 2.177768
H 0.793783 -0.439115 0.589304
H 1.225138 1.149599 -0.067643
H 2.418394 -1.507168 -1.116716
H 2.987818 0.120283 -1.524817
H 5.737149 -1.556599 1.617307
H 5.723616 0.228911 1.819100
H 6.794846 -0.524512 0.560265


