%chk=000189607.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189607

0 1
O 3.782907 -0.355149 -0.151705
O -0.308619 2.354680 -0.558227
O 2.531213 2.255038 -0.597842
O -1.901258 2.145613 1.138542
N 0.164938 -3.743114 -0.073237
C -0.562492 -2.479513 0.246130
C 0.282529 -1.221691 0.087010
C -1.819719 -2.374175 -0.647585
C 1.671847 -1.304942 0.041816
C -0.397645 0.016163 -0.042667
C 2.407146 -2.608213 0.167511
C 1.493143 -3.766232 0.601582
C -2.586287 -1.129663 -0.299514
C -1.861300 0.024793 0.074117
C 2.430533 -0.116195 -0.146756
C 0.362197 1.160017 -0.334913
C 1.779304 1.111908 -0.337050
C -2.606582 1.117474 0.569660
C -3.986571 -1.126685 -0.318460
C -4.012483 1.137046 0.546775
C -4.691424 0.012312 0.081214
C 4.683298 0.765124 -0.348606
C -0.034696 2.953371 -1.857460
C 2.404446 3.269153 0.442450
H -0.882312 -2.547463 1.324102
H -2.439602 -3.284985 -0.517453
H -1.540696 -2.349601 -1.721819
H 2.895470 -2.837481 -0.803608
H 3.246036 -2.493014 0.887933
H 0.299522 -3.824926 -1.088709
H 1.972852 -4.744230 0.384422
H 1.328875 -3.734757 1.701557
H -4.527943 -2.013546 -0.636931
H -4.557476 2.006269 0.896551
H -5.780888 0.014722 0.047440
H -2.476210 2.923019 1.340938
H 5.653813 0.260708 -0.410718
H 4.627670 1.439271 0.509844
H 4.436858 1.295124 -1.276054
H -0.442659 2.309096 -2.640642
H 1.040194 3.117897 -1.994790
H -0.583654 3.897625 -1.791358
H 3.005589 4.089386 0.040715
H 2.812288 2.886904 1.380897
H 1.352145 3.557060 0.560399


%chk=000189607-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000189607

0 1
O 3.851439 -0.324458 -0.225984
O -0.242052 2.414746 -0.707868
O 2.567183 2.281001 -0.724612
O -1.848718 2.110780 1.439664
N 0.140234 -3.716390 -0.201137
C -0.583566 -2.472327 0.150933
C 0.285096 -1.204776 0.060835
C -1.817697 -2.284243 -0.762713
C 1.691387 -1.301694 -0.013402
C -0.387163 0.054722 -0.020688
C 2.410281 -2.642047 0.087707
C 1.449833 -3.786465 0.496729
C -2.605543 -1.066322 -0.310415
C -1.864690 0.075610 0.125411
C 2.464355 -0.113596 -0.182441
C 0.388631 1.197436 -0.340555
C 1.810713 1.133518 -0.374289
C -2.583931 1.129228 0.759641
C -4.016381 -1.075920 -0.258150
C -4.000133 1.132641 0.784786
C -4.715977 0.040456 0.253178
C 4.786813 0.759810 0.118117
C -0.161760 2.677551 -2.164312
C 2.433593 3.420905 0.213521
H -0.947915 -2.587792 1.194188
H -2.444361 -3.192539 -0.725272
H -1.464866 -2.162226 -1.810301
H 2.883200 -2.875690 -0.888321
H 3.250681 -2.555647 0.802762
H 0.269324 -3.777392 -1.224356
H 1.914075 -4.769519 0.298012
H 1.243200 -3.736365 1.583206
H -4.563769 -1.958393 -0.607070
H -4.536165 1.971305 1.248827
H -5.811112 0.044494 0.276738
H -2.443191 2.839745 1.745564
H 5.759644 0.256283 0.235971
H 4.498221 1.243137 1.071341
H 4.828989 1.517020 -0.679604
H -0.693488 1.884745 -2.724332
H 0.891293 2.737915 -2.495244
H -0.666741 3.644414 -2.316418
H 3.007022 4.244408 -0.240200
H 2.865937 3.155578 1.198434
H 1.372369 3.700549 0.327617


