%chk=000290102.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000290102

0 1
O -3.406458 -0.024056 2.689422
O 1.334897 -0.604505 1.441129
O 3.852789 0.537802 0.934825
N -0.519335 -3.532000 -1.098912
C -0.992521 0.091677 0.047022
C -1.963955 0.341685 -1.156524
C -1.568404 0.695223 1.352578
C -0.849696 -1.443797 0.206319
C -3.394857 -0.123382 -0.830515
C 0.353961 0.787867 -0.172870
C -3.955856 0.526038 0.433895
C -1.927424 1.755753 -1.655158
C -3.012187 0.341598 1.604283
C 0.432232 1.912677 -1.031472
C -0.085262 -2.101799 -0.953923
C -0.789568 2.460687 -1.632725
C 1.519076 0.405822 0.521584
C 1.655418 2.545120 -1.279161
C 2.761019 1.046905 0.246731
C 2.826656 2.103666 -0.658532
C -0.000482 -4.371538 0.022386
C -0.047116 -4.081169 -2.406936
C 2.421488 -0.943868 2.338743
C 5.123468 1.208880 0.756872
H -1.588351 -0.299909 -2.009546
H -1.479932 1.802119 1.318610
H -0.939647 0.377592 2.213330
H -1.859708 -1.899399 0.293595
H -0.349581 -1.681887 1.168576
H -3.396700 -1.229849 -0.711248
H -4.064788 0.083157 -1.686945
H -4.950756 0.102754 0.680518
H -4.120710 1.611062 0.275405
H -2.850964 2.152221 -2.070338
H -0.326949 -1.572300 -1.905849
H 1.008539 -1.987482 -0.795411
H -0.725022 3.470271 -2.035578
H 1.701500 3.392724 -1.960920
H 3.768784 2.595960 -0.882569
H -0.363021 -5.403740 -0.102814
H -0.415857 -3.997343 0.971993
H 1.094925 -4.395499 0.113140
H 1.043636 -4.078746 -2.544804
H -0.503277 -3.501583 -3.224775
H -0.405366 -5.117856 -2.509981
H 2.752305 -0.059935 2.892144
H 3.247159 -1.387757 1.771204
H 1.942301 -1.677030 2.997533
H 5.452875 1.130306 -0.283169
H 5.775618 0.626136 1.419736
H 5.057106 2.249325 1.087305


%chk=000290102-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000290102

0 1
O -3.294906 -0.346798 2.726956
O 1.554311 -0.842248 1.211117
O 3.958368 0.393676 0.760047
N -0.406653 -3.662881 -1.144845
C -0.989546 0.048468 -0.025377
C -2.021943 0.422208 -1.163157
C -1.512371 0.613735 1.353928
C -0.918243 -1.514554 0.060266
C -3.479100 0.014323 -0.806233
C 0.389254 0.739171 -0.248421
C -3.948026 0.588622 0.559182
C -1.951653 1.876021 -1.588520
C -2.955102 0.226803 1.656498
C 0.447278 1.962878 -1.002373
C -0.156464 -2.197396 -1.094558
C -0.776689 2.558562 -1.553286
C 1.581885 0.308357 0.395191
C 1.672927 2.651732 -1.160768
C 2.826434 0.985677 0.172664
C 2.867562 2.163111 -0.602535
C 0.101693 -4.376434 0.046937
C 0.124104 -4.253898 -2.390784
C 2.032037 -0.699201 2.603519
C 5.259238 1.010720 0.487964
H -1.739355 -0.176266 -2.058728
H -1.461424 1.721160 1.309404
H -0.861206 0.264723 2.172789
H -1.946349 -1.921940 0.070608
H -0.449380 -1.788931 1.015770
H -3.583345 -1.085047 -0.791251
H -4.153692 0.380744 -1.604239
H -4.951591 0.220182 0.831425
H -3.989973 1.695295 0.484419
H -2.857024 2.333854 -2.009501
H -0.489170 -1.784390 -2.067266
H 0.935170 -1.975982 -1.000528
H -0.708511 3.583941 -1.938527
H 1.686545 3.584196 -1.736705
H 3.807145 2.697960 -0.766804
H -0.116978 -5.454946 -0.052791
H -0.404846 -4.012519 0.956008
H 1.205502 -4.252755 0.191849
H 1.237381 -4.165199 -2.487838
H -0.333550 -3.754611 -3.264144
H -0.136237 -5.327061 -2.434747
H 1.518376 0.142710 3.107217
H 3.122833 -0.546920 2.628622
H 1.760366 -1.647504 3.092773
H 5.469847 1.033586 -0.598474
H 5.992112 0.366535 0.995614
H 5.314962 2.037132 0.899834


