%chk=000218720.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000218720

0 1
O 2.647126 -0.155232 -0.558382
O -2.908436 1.277302 2.531385
N -5.566123 0.389806 0.325214
N -2.807039 -0.021215 0.625504
C 6.183440 0.674639 0.282897
C 7.480457 0.360674 -0.474695
C 4.961929 0.125584 -0.461067
C 8.709171 0.907879 0.265313
C 3.673112 0.440180 0.295772
C -4.994832 0.439369 1.704065
C -5.697710 1.777266 -0.239305
C -6.873533 -0.346847 0.299905
C 10.002616 0.597924 -0.484655
C -3.474497 0.632693 1.663417
C -5.816816 1.708902 -1.761338
C -6.639031 -1.846614 0.479123
C 1.333648 -0.049982 -0.157415
C -1.393504 0.001560 0.389384
C 0.437374 -0.661577 -1.060421
C 0.881310 0.582324 1.005630
C -0.921756 -0.632760 -0.784658
C -0.489223 0.605924 1.276668
H 6.231593 0.244463 1.302493
H 6.084461 1.769507 0.418586
H 7.435880 0.788526 -1.494967
H 7.582537 -0.733117 -0.613278
H 4.902235 0.547315 -1.485143
H 5.048505 -0.970772 -0.604927
H 8.757147 0.478580 1.285310
H 8.610296 2.002630 0.402179
H 3.477848 1.522194 0.379048
H 3.629328 -0.041154 1.286838
H -5.424501 1.240698 2.347785
H -5.197377 -0.520025 2.236968
H -6.556923 2.335881 0.190327
H -4.781696 2.352863 0.028306
H -7.590941 0.024736 1.063140
H -7.345447 -0.167203 -0.693712
H 10.005021 1.041532 -1.486886
H 10.151779 -0.481279 -0.604397
H 10.874356 0.991743 0.049954
H -5.774558 2.711716 -2.200996
H -6.754533 1.241395 -2.082841
H -4.998119 1.119895 -2.196072
H -5.901806 -2.221052 -0.243448
H -6.261377 -2.090693 1.479007
H -7.567512 -2.408418 0.328904
H -3.380481 -0.476963 -0.097201
H 0.827430 -1.143084 -1.954695
H 1.567126 1.054745 1.701889
H -1.619980 -1.101226 -1.476617
H -0.854476 1.101467 2.185105


%chk=000218720-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000218720

0 1
O 2.544690 -0.025964 -0.776519
O -2.965578 1.309723 2.874173
N -5.555665 0.385356 0.398807
N -2.903934 0.350154 0.709724
C 6.170933 0.554335 0.260042
C 7.514489 0.325855 -0.468730
C 4.949163 0.156676 -0.599811
C 8.744123 0.713498 0.383833
C 3.626360 0.401094 0.129329
C -5.064943 0.639640 1.779412
C -5.823632 1.666855 -0.327190
C -6.694769 -0.578137 0.338807
C 10.081930 0.489014 -0.353745
C -3.528935 0.818445 1.847180
C -5.802234 1.517927 -1.859275
C -6.262849 -2.032441 0.601377
C 1.221959 0.108197 -0.319678
C -1.519112 0.289908 0.404805
C 0.217474 -0.322970 -1.222174
C 0.849863 0.630265 0.943433
C -1.136678 -0.232311 -0.862592
C -0.512083 0.721562 1.305389
H 6.166124 -0.026996 1.205889
H 6.091619 1.623178 0.549886
H 7.524207 0.910767 -1.411994
H 7.595458 -0.741073 -0.763863
H 4.947842 0.732220 -1.545440
H 5.012622 -0.913615 -0.875320
H 8.735726 0.125363 1.324322
H 8.659379 1.778442 0.682534
H 3.502029 1.476579 0.377233
H 3.576847 -0.185995 1.070891
H -5.522951 1.536912 2.248539
H -5.313803 -0.219147 2.429464
H -6.794694 2.109915 0.001188
H -5.032493 2.380181 -0.029769
H -7.502558 -0.284260 1.052072
H -7.130674 -0.516335 -0.673961
H 10.128506 1.090185 -1.281399
H 10.204987 -0.573428 -0.637037
H 10.944857 0.772672 0.276405
H -5.953647 2.503462 -2.336280
H -6.596764 0.845428 -2.228750
H -4.829328 1.117518 -2.196226
H -5.515458 -2.354253 -0.144996
H -5.817780 -2.160137 1.604597
H -7.135800 -2.707730 0.537028
H -3.603679 0.018075 0.017302
H 0.520541 -0.724054 -2.194025
H 1.605480 0.969832 1.658020
H -1.906513 -0.571267 -1.567149
H -0.807153 1.123578 2.277243


