%chk=000209666.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000209666

0 1
O -1.534691 1.056597 0.820624
O -2.206625 1.410817 -1.321856
N 2.519768 0.272429 0.762535
C 1.912727 0.305651 -0.615083
C -0.406620 0.152801 0.479368
C 0.478523 0.868689 -0.544384
C 2.771034 1.202964 -1.533045
C 0.297852 0.054247 1.844793
C 1.690698 -0.567028 1.691075
C 3.924513 -0.258991 0.723594
C 4.217641 0.701767 -1.596879
C 4.800398 0.621536 -0.181422
C -1.004787 -1.177441 0.053707
C -2.200300 -1.607132 0.654277
C -0.380495 -2.001797 -0.889648
C -2.364051 1.586888 -0.139008
C -2.764930 -2.835353 0.306607
C -0.945813 -3.233256 -1.236434
C -3.437184 2.374108 0.571657
C -2.138473 -3.652140 -0.641381
C -3.689837 3.698147 -0.135723
H 1.866088 -0.728706 -1.063229
H 0.520392 1.944588 -0.268916
H 0.003608 0.839042 -1.548279
H 2.756673 2.243828 -1.151260
H 2.326925 1.236404 -2.544120
H -0.310103 -0.527742 2.560665
H 0.383168 1.076445 2.273606
H 2.193605 -0.579810 2.683142
H 1.599437 -1.624891 1.358756
H 3.974441 -1.316300 0.384201
H 4.322270 -0.230049 1.761680
H 4.826910 1.379907 -2.222926
H 4.261104 -0.288790 -2.087292
H 5.830499 0.223227 -0.205592
H 4.866967 1.640261 0.251788
H -2.688385 -0.969893 1.392657
H 0.555731 -1.687879 -1.362326
H -3.694119 -3.157638 0.772828
H -0.455246 -3.863917 -1.975679
H -4.362181 1.757565 0.594201
H -3.156544 2.539756 1.634678
H -2.579779 -4.608402 -0.914586
H -3.899562 3.547052 -1.205335
H -4.547990 4.222419 0.300827
H -2.822758 4.367321 -0.067760


%chk=000209666-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000209666

0 1
O -1.493968 1.247121 0.910117
O -2.253600 1.398564 -1.305051
N 2.625288 0.185599 0.835873
C 2.014446 0.327163 -0.517827
C -0.343018 0.292189 0.558144
C 0.621772 0.997862 -0.421375
C 2.936914 1.165104 -1.432481
C 0.381765 0.153615 1.917250
C 1.733459 -0.563581 1.755686
C 3.972563 -0.438554 0.774291
C 4.355234 0.562041 -1.519080
C 4.937133 0.385846 -0.098914
C -0.966362 -1.028393 0.074306
C -1.817972 -1.749854 0.953326
C -0.753234 -1.548214 -1.225708
C -2.373678 1.672352 -0.089404
C -2.424010 -2.959007 0.552250
C -1.352343 -2.761609 -1.630004
C -3.497066 2.496145 0.529540
C -2.187310 -3.476121 -0.742564
C -4.231642 3.370502 -0.503659
H 1.901212 -0.689295 -0.981956
H 0.770398 2.026755 -0.040964
H 0.176657 1.078892 -1.426235
H 2.997159 2.192066 -1.020154
H 2.479282 1.236015 -2.438379
H -0.247103 -0.388211 2.644303
H 0.559320 1.169931 2.311907
H 2.229639 -0.626720 2.742307
H 1.565596 -1.614234 1.402285
H 3.912693 -1.482827 0.364093
H 4.361538 -0.514938 1.807611
H 5.012001 1.206343 -2.133735
H 4.308827 -0.426222 -2.022219
H 5.921951 -0.118341 -0.137329
H 5.084817 1.378694 0.368190
H -2.026139 -1.352325 1.952959
H -0.138983 -0.997439 -1.943088
H -3.081421 -3.495426 1.245960
H -1.175663 -3.142135 -2.642337
H -4.202078 1.780589 0.999491
H -3.078989 3.097118 1.356764
H -2.654655 -4.416040 -1.057049
H -4.606658 2.755096 -1.338644
H -5.086111 3.887928 -0.032664
H -3.557162 4.133256 -0.930728


