%chk=000209991.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000209991

0 1
O 0.428082 -0.709250 -0.082396
O 4.408821 0.108383 0.139361
N -3.061728 0.027061 0.703132
C -3.802261 1.044044 -0.135611
C -3.619448 -0.108346 2.091259
C -1.581340 0.211481 0.685986
C -3.176702 1.153487 -1.534414
C -5.269910 0.607559 -0.274390
C -3.069551 -1.385898 2.740408
C -3.373064 1.113492 2.992591
C -1.009459 -1.004022 -0.062431
C 1.283921 -1.612718 -0.654264
C 2.651255 -1.259689 -0.602398
C 2.230545 1.049122 0.449004
C 2.914496 2.345556 0.891293
C 3.205326 -0.016078 0.010728
C 3.451531 3.172250 -0.285844
C 0.854864 -2.811390 -1.253609
C 3.576251 -2.157459 -1.167474
C 1.803886 -3.668874 -1.806722
C 2.348102 3.839658 -1.103144
C 3.166109 -3.347257 -1.766169
H -3.768640 2.055245 0.351450
H -4.732455 -0.236303 1.971880
H -1.257767 1.149583 0.184092
H -1.142316 0.258217 1.706741
H -3.769116 1.815989 -2.174953
H -2.157739 1.555712 -1.504851
H -3.131594 0.175112 -2.028385
H -5.823896 1.292286 -0.924022
H -5.783829 0.578422 0.694128
H -5.342987 -0.397760 -0.709083
H -2.004277 -1.309936 2.982187
H -3.192645 -2.246733 2.071107
H -3.600911 -1.609192 3.671375
H -3.846223 0.979731 3.971312
H -3.783531 2.028675 2.553807
H -2.307159 1.285781 3.174621
H -1.371735 -1.076067 -1.100115
H -1.175590 -1.949629 0.477304
H 1.605536 0.639518 1.273258
H 1.508127 1.252696 -0.372529
H 2.206443 2.950440 1.487617
H 3.760508 2.096161 1.567368
H 4.069034 2.520649 -0.938345
H 4.145526 3.944255 0.101381
H -0.196579 -3.075882 -1.291494
H 4.641598 -1.897288 -1.123827
H 1.480443 -4.599933 -2.274817
H 1.748119 4.520709 -0.490163
H 1.666880 3.099704 -1.537984
H 2.768625 4.423157 -1.929816
H 3.900425 -4.022828 -2.197642


%chk=000209991-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000209991

0 1
O 0.386945 -0.574290 -0.133151
O 4.577643 0.102057 0.098671
N -3.228488 -0.013793 0.680802
C -4.063045 0.882841 -0.187515
C -3.714529 -0.218494 2.084729
C -1.771260 0.256426 0.577639
C -3.693211 0.684066 -1.677029
C -5.577195 0.626419 -0.014096
C -3.001075 -1.415885 2.750675
C -3.633369 1.053101 2.978601
C -1.056295 -0.908617 -0.125166
C 1.288322 -1.485461 -0.696305
C 2.687558 -1.178801 -0.633092
C 2.450485 1.206704 0.494322
C 3.262847 2.427138 0.974338
C 3.312799 0.048498 -0.007281
C 3.941122 3.243183 -0.156043
C 0.847661 -2.690603 -1.306237
C 3.594873 -2.118591 -1.198830
C 1.778003 -3.591647 -1.860310
C 2.949045 3.939012 -1.115123
C 3.162810 -3.308448 -1.809339
H -3.868070 1.957395 0.067220
H -4.778186 -0.502313 1.998659
H -1.570015 1.194281 0.022235
H -1.313410 0.390016 1.575770
H -4.283963 1.374053 -2.307135
H -2.626915 0.886564 -1.878986
H -3.916367 -0.353877 -1.985777
H -6.131580 1.206054 -0.773894
H -5.957195 0.934835 0.975340
H -5.808057 -0.444670 -0.164200
H -1.927386 -1.219165 2.928154
H -3.092233 -2.317034 2.118649
H -3.461570 -1.630458 3.732449
H -4.087477 0.859751 3.968153
H -4.171700 1.901984 2.518209
H -2.585711 1.365080 3.148420
H -1.425341 -1.028662 -1.161181
H -1.220332 -1.852175 0.429222
H 1.816018 0.810994 1.313443
H 1.720839 1.478949 -0.291704
H 2.584849 3.096387 1.543219
H 4.044669 2.078410 1.675002
H 4.616143 2.576647 -0.723893
H 4.585823 4.013960 0.311707
H -0.218121 -2.929314 -1.349915
H 4.658781 -1.867851 -1.130615
H 1.418138 -4.514394 -2.329421
H 2.261946 4.607528 -0.560999
H 2.332564 3.208170 -1.670832
H 3.485279 4.552031 -1.863182
H 3.888934 -4.006385 -2.237879


