%chk=000213996.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213996

0 1
O 1.206053 1.965860 1.461682
O -0.716070 -2.204220 -1.380465
O 1.936433 -0.381445 -2.467783
O 3.866343 -0.080858 0.419919
O -2.930293 -2.450049 -1.013831
O 5.322254 -0.602346 -1.231887
N -0.052261 0.058173 -1.282223
N 1.934963 0.882593 -0.469048
C -0.424556 0.742993 0.002818
C 0.963500 1.297175 0.496781
C -1.324647 1.949530 -0.223515
C -0.982423 -0.245712 1.013509
C 1.352979 0.085920 -1.525573
C -0.918732 -0.886687 -1.977447
C 3.380610 1.078766 -0.309749
C -1.751132 2.348745 -1.494920
C -0.112100 -1.050199 1.766739
C -1.710604 2.697225 0.904265
C -2.367652 -0.374875 1.187759
C -2.576662 3.470657 -1.635936
C -0.625011 -1.955522 2.698712
C -2.530787 3.815696 0.757905
C -2.876104 -1.284293 2.120309
C -2.970489 4.202448 -0.513790
C -2.007166 -2.072232 2.880003
C -1.810486 -2.879719 -0.869951
C 4.804885 -0.908363 -0.188704
C -1.344081 -4.124214 -0.207518
C 5.021674 -2.093042 0.681301
H -1.988885 -0.592490 -1.896628
H -0.570278 -1.022671 -3.027007
H 3.889610 1.158151 -1.298087
H 3.580186 1.933444 0.373531
H -1.441065 1.806556 -2.387625
H 0.968740 -0.977605 1.634756
H -1.353978 2.407471 1.896267
H -3.058894 0.226392 0.593041
H -2.908204 3.773596 -2.628470
H 0.055939 -2.564908 3.291293
H -2.825381 4.390743 1.635150
H -3.954598 -1.379513 2.247230
H -3.612975 5.074544 -0.626663
H -2.405050 -2.771798 3.613704
H -1.306136 -3.980972 0.887133
H -2.029070 -4.962113 -0.409224
H -0.332171 -4.418075 -0.531744
H 4.539692 -1.986993 1.666829
H 6.097216 -2.268769 0.844493
H 4.612463 -3.000297 0.206261


%chk=000213996-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000213996

0 1
O 1.412387 1.702502 1.357287
O -1.209799 -2.369247 -1.409145
O 1.667479 -0.678967 -2.687447
O 3.918655 -0.296003 0.067772
O -3.543565 -2.239656 -1.303998
O 5.989025 0.680802 -0.357641
N -0.165394 -0.202104 -1.241338
N 1.876347 0.603010 -0.683467
C -0.402163 0.553620 0.029934
C 1.049090 1.038703 0.364848
C -1.250911 1.824930 -0.199819
C -0.943176 -0.371938 1.141203
C 1.166072 -0.170799 -1.660482
C -1.150601 -0.970422 -1.949354
C 3.298351 0.804178 -0.736651
C -1.535690 2.303259 -1.501449
C -0.053432 -1.150274 1.923672
C -1.672571 2.582969 0.922799
C -2.338173 -0.514223 1.339059
C -2.258012 3.504822 -1.679821
C -0.550056 -2.043143 2.896744
C -2.387009 3.785363 0.742834
C -2.835868 -1.411503 2.309182
C -2.689437 4.248412 -0.559357
C -1.944230 -2.176711 3.094869
C -2.485235 -2.875503 -1.099257
C 5.318618 -0.228383 0.178450
C -2.363774 -4.249457 -0.484711
C 5.837757 -1.381631 1.005969
H -2.155569 -0.525202 -1.866619
H -0.833072 -1.070572 -2.999220
H 3.648064 0.729965 -1.778631
H 3.568877 1.772747 -0.286950
H -1.187302 1.750773 -2.380332
H 1.030023 -1.059395 1.786256
H -1.427074 2.237709 1.932134
H -3.041400 0.072383 0.738811
H -2.477900 3.859155 -2.692811
H 0.149067 -2.629928 3.502580
H -2.704034 4.362541 1.618184
H -3.917797 -1.511506 2.446066
H -3.247733 5.180729 -0.697819
H -2.329915 -2.864415 3.855782
H -2.104297 -4.138978 0.584245
H -3.324266 -4.779666 -0.564715
H -1.559907 -4.825963 -0.968748
H 5.368933 -1.374859 2.004872
H 6.929529 -1.301449 1.105272
H 5.576687 -2.339978 0.524563


