%chk=000236462.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000236462

0 1
O 3.647179 -0.494723 0.054365
O -4.318880 1.201227 0.725501
O 4.009002 1.738740 -0.011985
N 0.006823 0.081091 -0.328186
N -2.883442 -0.130901 -0.436037
C -0.695040 -1.089839 0.292616
C -0.843499 1.313986 -0.248759
C -2.018999 -1.336672 -0.464499
C -2.180973 1.067202 -0.977039
C 1.347789 0.299966 0.296233
C 2.374371 -0.347888 -0.643815
C -3.884838 0.075269 0.538708
C -4.457464 -1.133505 1.224251
C 4.397032 0.637022 0.295970
C 5.666912 0.238737 0.962645
H -0.894197 -0.953990 1.376978
H -0.039010 -1.980958 0.190049
H -0.298851 2.139663 -0.758477
H -1.036644 1.644704 0.794532
H -1.800365 -1.567578 -1.535230
H -2.544341 -2.218642 -0.048526
H -2.841140 1.961249 -0.876344
H -2.006057 0.897645 -2.062952
H 1.446407 -0.122418 1.318208
H 1.583588 1.385412 0.394546
H 2.531264 0.243531 -1.561540
H 2.139438 -1.397287 -0.894294
H -5.325973 -0.832896 1.834715
H -3.737977 -1.609080 1.900924
H -4.815210 -1.887421 0.510870
H 5.722966 -0.845386 1.150814
H 5.781553 0.757000 1.927651
H 6.534475 0.516139 0.342407


%chk=000236462-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000236462

0 1
O 3.752471 -0.567932 0.214507
O -4.761532 1.147833 0.303430
O 4.209221 1.531959 -0.697213
N 0.039138 0.137963 -0.052054
N -2.824546 -0.042292 -0.186871
C -0.664344 -1.051436 0.483321
C -0.798096 1.358169 0.085640
C -2.002188 -1.263173 -0.259058
C -2.130964 1.174040 -0.663037
C 1.419000 0.287047 0.463035
C 2.395390 -0.527490 -0.407617
C -4.139098 0.039162 0.270058
C -4.808218 -1.257957 0.731032
C 4.572052 0.545186 -0.016291
C 5.919755 0.372755 0.649472
H -0.868517 -0.945617 1.580055
H -0.030538 -1.946515 0.344184
H -0.251647 2.212296 -0.352909
H -1.013054 1.595708 1.157296
H -1.783103 -1.498428 -1.320849
H -2.541433 -2.115088 0.182284
H -2.806879 2.028319 -0.496499
H -1.927245 1.076703 -1.748168
H 1.515465 -0.035176 1.527109
H 1.710428 1.350507 0.410921
H 2.463496 -0.085593 -1.415847
H 2.103722 -1.587673 -0.471697
H -5.839403 -1.008368 1.020183
H -4.295014 -1.699831 1.604944
H -4.838188 -2.018134 -0.070735
H 5.967350 -0.564097 1.222414
H 6.112744 1.231420 1.315299
H 6.709675 0.375129 -0.122042


