%chk=000184860.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000184860

0 1
O -0.038810 0.039363 -2.041956
O 4.779500 1.142723 0.403642
O -3.301758 -1.025008 -1.880523
N -4.221639 -0.277845 -1.145373
C 1.108670 0.320823 -1.335606
C 3.556728 0.769276 -0.177905
C -1.323712 0.344990 -1.418761
C 2.279643 -0.006600 -2.058001
C 1.156037 0.866726 -0.046655
C 3.516552 0.222578 -1.472144
C 2.404777 1.089255 0.543403
C -2.323533 -0.119903 -2.476946
C 5.700419 0.145601 0.704138
C 5.427061 -1.225789 0.679093
C 6.955539 0.659120 1.078866
C -6.194917 -0.436658 0.223520
C 6.451557 -2.106721 1.041021
C 7.954089 -0.243712 1.436024
C 7.708013 -1.624310 1.416525
C -6.846046 -1.243572 1.173808
C -6.574839 0.906742 0.072662
C -5.127061 -1.039277 -0.600682
C -7.863579 -0.705872 1.964094
C -7.596256 1.436153 0.866120
C -8.241098 0.633043 1.811337
H -1.422792 -0.232942 -0.481863
H -1.373816 1.426945 -1.215649
H 2.189803 -0.426813 -3.058159
H 0.252794 1.116800 0.501408
H 4.443564 -0.006798 -1.997041
H 2.487103 1.513412 1.543663
H -1.846229 -0.791651 -3.222521
H -2.831645 0.715674 -2.984531
H 4.447114 -1.600132 0.396693
H 7.120779 1.733448 1.084941
H 6.262123 -3.180066 1.030162
H 8.935479 0.127304 1.731533
H 8.496770 -2.318095 1.695578
H -6.556754 -2.285757 1.299306
H -6.070333 1.535430 -0.662624
H -5.158846 -2.136783 -0.703455
H -8.365060 -1.331215 2.701412
H -7.888973 2.478444 0.746278
H -9.036421 1.048072 2.428267


%chk=000184860-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000184860

0 1
O -0.127342 -0.509969 -1.852366
O 4.401558 0.552157 1.334288
O -3.671006 -1.611286 -1.877272
N -4.336902 -0.524617 -1.147618
C 0.973758 -0.287767 -1.006435
C 3.299281 0.212183 0.503316
C -1.380401 -0.958391 -1.230139
C 2.157982 0.150610 -1.650865
C 0.953992 -0.468198 0.398448
C 3.319137 0.406308 -0.899929
C 2.124848 -0.217967 1.149466
C -2.381699 -1.104814 -2.380629
C 5.719438 0.170274 0.980833
C 6.016894 -0.956266 0.177608
C 6.751901 0.948597 1.552074
C -6.386098 -0.052857 0.067440
C 7.369598 -1.291619 -0.057343
C 8.097258 0.598277 1.310278
C 8.414224 -0.519959 0.502123
C -7.630241 -0.561987 0.532375
C -6.040399 1.298885 0.357404
C -5.500155 -0.943386 -0.696898
C -8.510663 0.258104 1.270164
C -6.921539 2.113029 1.093835
C -8.159761 1.597945 1.553794
H -1.232472 -1.929595 -0.716024
H -1.748783 -0.209677 -0.501644
H 2.144753 0.294727 -2.735356
H 0.048724 -0.798896 0.915265
H 4.228105 0.761836 -1.395037
H 2.133760 -0.346941 2.235763
H -2.046643 -1.869042 -3.101157
H -2.527250 -0.139826 -2.896462
H 5.211961 -1.564880 -0.245623
H 6.484053 1.808309 2.173658
H 7.603570 -2.165392 -0.675959
H 8.898280 1.201365 1.751983
H 9.459416 -0.787524 0.314698
H -7.904413 -1.601491 0.313412
H -5.083439 1.690410 -0.002526
H -5.836252 -1.976077 -0.886649
H -9.466300 -0.145545 1.622195
H -6.648649 3.151470 1.312319
H -8.842086 2.235886 2.126290


