%chk=000299169.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299169

0 1
O 0.095977 0.103603 0.678831
O -0.568210 -2.039784 0.982898
N 2.608674 2.318320 0.051594
N -5.875650 0.929163 -1.206853
C 2.380685 -0.168192 -0.168412
C 3.848291 -0.354403 0.296772
C 1.984440 -1.266113 -1.184604
C 4.408525 -1.758775 0.033090
C 2.134134 -2.687766 -0.624167
C 2.200743 1.211819 -0.876043
C 3.365517 -2.853265 0.280324
C 1.465703 -0.233507 1.075894
C 1.422385 3.102663 0.508126
C 3.607958 3.224203 -0.589337
C -0.840749 -0.905983 0.644720
C -2.139302 -0.394058 0.176415
C -3.227222 -1.286804 0.115552
C -2.314806 0.947540 -0.206737
C -4.472930 -0.852804 -0.314977
C -3.553114 1.402256 -0.640005
C -4.643694 0.499727 -0.702275
H 3.935226 -0.107839 1.372226
H 4.495636 0.390058 -0.205533
H 2.610173 -1.162012 -2.091043
H 0.938433 -1.112339 -1.511193
H 5.294168 -1.929771 0.673163
H 4.770514 -1.826140 -1.011233
H 2.182554 -3.402981 -1.465487
H 1.219266 -2.956759 -0.051164
H 1.140143 1.303679 -1.196829
H 2.802023 1.217667 -1.807608
H 3.818459 -3.848878 0.120756
H 3.052893 -2.832473 1.342536
H 1.699130 0.560655 1.807943
H 1.481582 -1.225620 1.560035
H 0.673112 2.410215 0.933145
H 0.932901 3.700541 -0.273346
H 1.738499 3.779884 1.316968
H 4.504149 2.640659 -0.853616
H 3.922992 3.982773 0.145296
H 3.253367 3.745797 -1.489923
H -3.076565 -2.329430 0.415479
H -1.462081 1.631945 -0.157021
H -5.305528 -1.548423 -0.365001
H -3.680046 2.438103 -0.939321
H -6.059287 1.916824 -1.267381
H -6.691469 0.361722 -1.046554


%chk=000299169-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000299169

0 1
O -0.085015 0.216141 0.689594
O -0.922779 -1.863679 1.371213
N 2.640349 2.259534 -0.008500
N -6.150209 0.969151 -1.274143
C 2.289360 -0.281389 0.047294
C 3.676401 -0.551359 0.720677
C 1.911308 -1.460578 -0.906425
C 4.607225 -1.364375 -0.205620
C 2.482641 -2.807187 -0.409628
C 2.344969 1.035197 -0.795243
C 4.040116 -2.796341 -0.440590
C 1.270968 -0.143066 1.198673
C 1.484431 3.159956 0.171752
C 3.851811 2.984041 -0.434351
C -1.107063 -0.740540 0.830679
C -2.393964 -0.260957 0.276804
C -3.527817 -1.115063 0.357885
C -2.542232 1.013583 -0.335273
C -4.770904 -0.715480 -0.151556
C -3.781507 1.424563 -0.848470
C -4.920148 0.565824 -0.765913
H 3.535077 -1.122593 1.661882
H 4.121324 0.419200 1.009689
H 2.313308 -1.252506 -1.920033
H 0.812776 -1.518771 -1.016344
H 5.625306 -1.422821 0.224759
H 4.711427 -0.836498 -1.175236
H 2.094557 -3.639850 -1.026231
H 2.118529 -2.994114 0.619247
H 1.378649 1.140757 -1.333480
H 3.123389 0.900597 -1.574623
H 4.401763 -3.181009 -1.414274
H 4.429066 -3.484989 0.334640
H 1.568134 0.691233 1.857300
H 1.185310 -1.081226 1.775072
H 0.616077 2.587015 0.536746
H 1.182794 3.681852 -0.773048
H 1.728102 3.935483 0.921846
H 4.712116 2.292937 -0.477758
H 4.090816 3.774821 0.301264
H 3.751965 3.472666 -1.437568
H -3.405674 -2.095874 0.829685
H -1.673619 1.674731 -0.401654
H -5.635651 -1.386367 -0.080381
H -3.881506 2.411059 -1.317533
H -6.261693 1.880311 -1.709767
H -6.962682 0.361675 -1.216957


