%chk=000218205.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000218205

0 1
O -1.481744 1.026849 0.425454
O -3.770074 0.415296 0.558753
O 0.587484 -0.780455 -0.841142
O 1.105104 -1.218268 1.355859
O 4.843506 0.279702 0.356190
N 2.683660 -0.267311 -0.105041
C -2.811854 1.501671 0.895860
C -1.668819 -0.238610 -0.088173
C -3.047235 -0.609012 -0.015628
C -3.181159 2.720416 0.091953
C -2.763780 1.634084 2.395223
C -0.751744 -1.124010 -0.628818
C -3.515637 -1.823574 -0.471077
C -1.207165 -2.378424 -1.094580
C -2.556268 -2.706535 -1.018433
C 1.433747 -0.786255 0.277901
C 2.848062 0.298368 -1.485368
C 3.810358 -0.159029 0.806263
C 2.193805 1.649631 -1.592782
C 3.598803 -0.616051 2.205253
C 2.812482 2.715061 -2.093841
H -4.133708 3.152960 0.426174
H -2.406497 3.496754 0.164173
H -3.293077 2.476270 -0.975877
H -2.295579 0.749993 2.858074
H -2.178669 2.507751 2.710456
H -3.773146 1.723082 2.821038
H -4.566210 -2.092522 -0.410209
H -0.480525 -3.072826 -1.514159
H -2.893708 -3.676820 -1.385880
H 3.942389 0.344021 -1.711509
H 2.387218 -0.405023 -2.221039
H 1.157342 1.682432 -1.244169
H 3.293888 -1.676588 2.263309
H 4.516740 -0.494219 2.800785
H 2.788051 -0.062253 2.711786
H 2.335669 3.680125 -2.195605
H 3.838291 2.713719 -2.436673


%chk=000218205-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000218205

0 1
O -1.486485 0.999340 0.343505
O -3.817924 0.433583 0.515490
O 0.553227 -0.820779 -0.933519
O 0.848990 -0.845852 1.398965
O 4.729205 0.545620 0.489088
N 2.589927 -0.166279 -0.081192
C -2.776626 1.401227 1.039792
C -1.732495 -0.276983 -0.188703
C -3.102050 -0.612086 -0.107992
C -3.147175 2.807441 0.598836
C -2.606078 1.178909 2.540540
C -0.823273 -1.158455 -0.781838
C -3.613842 -1.801938 -0.633500
C -1.307249 -2.373793 -1.322851
C -2.683873 -2.683775 -1.251360
C 1.306986 -0.619445 0.261390
C 2.951089 0.070641 -1.523152
C 3.603902 0.153444 0.895842
C 2.427798 1.401386 -2.029809
C 3.287903 0.011363 2.371565
C 3.230778 2.413201 -2.439636
H -4.100148 3.108057 1.065950
H -2.360629 3.516934 0.906556
H -3.257324 2.846145 -0.496440
H -2.304701 0.137189 2.740318
H -1.825269 1.851083 2.934852
H -3.556478 1.384538 3.061849
H -4.678659 -2.038662 -0.570703
H -0.595468 -3.061897 -1.787711
H -3.041866 -3.627831 -1.673306
H 4.050517 0.048116 -1.570485
H 2.536270 -0.761873 -2.113161
H 1.334969 1.507672 -2.065340
H 3.014218 -1.024669 2.631647
H 4.186149 0.319332 2.927064
H 2.425517 0.634286 2.662151
H 2.816451 3.354697 -2.818199
H 4.323719 2.330513 -2.402003


