%chk=000189030.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189030

1 1
O 1.365174 -1.395833 -0.833819
O -3.987354 -1.748703 0.086449
O 0.379808 -1.668861 1.228710
N -0.862074 -1.055770 -0.643076
N -2.799502 -3.645348 2.169340
N -3.187628 -4.557355 2.683981
C -1.970339 -0.478455 0.143744
C -2.828365 0.484124 -0.692930
C -2.026626 1.690384 -1.108643
C -2.793038 -1.692736 0.646222
C -1.593208 1.819174 -2.435523
C -1.720024 2.686038 -0.169670
C 0.341028 -1.368996 0.042677
C -0.849872 2.940129 -2.818213
C -0.975366 3.802780 -0.559212
C -2.278828 -2.559904 1.593878
C 2.711683 -1.745661 -0.304506
C -0.537608 3.930429 -1.881776
C 3.335432 -0.523165 0.286674
C 4.130634 0.316190 -0.507656
C 3.132629 -0.219842 1.642477
C 4.729331 1.446181 0.056605
C 3.732951 0.910525 2.200538
C 4.533357 1.742550 1.409308
H -1.588777 0.057173 1.068996
H -3.718945 0.808771 -0.108320
H -3.257340 -0.031471 -1.581126
H -0.778092 -0.717203 -1.614376
H -1.845210 1.065709 -3.179502
H -2.067242 2.605670 0.858116
H -0.516940 3.043917 -3.852336
H -0.738792 4.579823 0.169547
H 3.188739 -2.092425 -1.243412
H 2.602808 -2.581468 0.409271
H -1.184923 -2.326741 1.909211
H 0.041319 4.804742 -2.183381
H -4.585314 -2.516078 0.342501
H 4.287094 0.090775 -1.562497
H 2.503247 -0.866474 2.256963
H 5.353512 2.095138 -0.558654
H 3.583543 1.142616 3.254937
H 5.007315 2.621352 1.848785


%chk=000189030-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000189030

1 1
O 1.345543 -1.336961 -0.776907
O -4.074218 -1.898167 0.011616
O 0.280839 -1.642558 1.292295
N -0.879215 -0.903403 -0.605145
N -2.826492 -3.685046 2.040429
N -3.204010 -4.664276 2.558862
C -2.086352 -0.484698 0.136034
C -2.947623 0.483165 -0.722798
C -2.144447 1.706804 -1.146640
C -2.860494 -1.733630 0.588878
C -1.740083 1.867314 -2.496566
C -1.776158 2.693823 -0.195804
C 0.266707 -1.310459 0.052754
C -0.977534 2.991306 -2.889702
C -1.014116 3.815716 -0.586189
C -2.262443 -2.571055 1.539450
C 2.702559 -1.731149 -0.166437
C -0.609761 3.965281 -1.934164
C 3.420681 -0.527968 0.381174
C 4.208105 0.284236 -0.476114
C 3.329976 -0.204293 1.760338
C 4.889593 1.408771 0.036316
C 4.014824 0.918741 2.273192
C 4.794150 1.726748 1.412083
H -1.764721 0.037203 1.060654
H -3.827244 0.777903 -0.122751
H -3.333375 -0.054634 -1.607061
H -0.778326 -0.580175 -1.572929
H -2.048270 1.131533 -3.251498
H -2.101643 2.600712 0.848723
H -0.680424 3.110123 -3.936833
H -0.743026 4.576111 0.153584
H 3.205341 -2.173058 -1.039152
H 2.497584 -2.493688 0.602616
H -1.192477 -2.318007 1.813892
H -0.023030 4.838484 -2.237466
H -4.591971 -2.709918 0.264360
H 4.290238 0.033124 -1.540552
H 2.726155 -0.833350 2.424487
H 5.500752 2.028534 -0.627986
H 3.950864 1.159147 3.339643
H 5.331740 2.593413 1.811618


