%chk=000201989.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000201989

0 1
O -3.097333 0.144079 -2.437931
O 2.722571 0.037152 0.261425
N -3.642177 -0.369596 -0.295054
C -5.750780 0.069862 0.792325
C -4.703945 -0.249037 1.877481
C -5.109813 -0.306787 -0.553819
C -3.344015 -0.382748 1.164460
C -2.722320 -0.048106 -1.290572
C -1.280572 -0.021140 -0.872763
C 0.752508 -1.197379 -0.271906
C 0.729404 1.267028 -0.431158
C -0.626114 1.211575 -0.780633
C -0.604341 -1.217989 -0.620407
C 1.400751 0.051857 -0.184272
C 1.492492 -2.473188 0.008397
C 1.423910 2.593374 -0.312323
C 1.059755 -3.089660 1.349055
C 1.789482 2.898889 1.149992
C 1.799361 -4.394573 1.630462
C 2.486796 4.248359 1.287420
C 3.711453 0.363733 -0.768523
C 5.021180 0.203997 -0.063546
C 6.195549 0.376118 -0.663651
H -6.016540 1.141906 0.811804
H -6.686874 -0.487567 0.960660
H -4.961245 -1.186858 2.400771
H -4.675351 0.540740 2.646455
H -5.332379 0.425361 -1.359896
H -5.451577 -1.301525 -0.911503
H -2.836052 -1.335307 1.424770
H -2.655544 0.445391 1.434136
H -1.172983 2.131743 -0.990121
H -1.128880 -2.170209 -0.705692
H 2.588182 -2.279054 0.030606
H 1.329147 -3.195965 -0.816079
H 0.796150 3.408293 -0.724280
H 2.349388 2.587747 -0.934129
H 1.250771 -2.363780 2.165008
H -0.032853 -3.268143 1.348474
H 0.876500 2.876896 1.775602
H 2.443500 2.087715 1.537810
H 1.490596 -4.824942 2.589862
H 2.884164 -4.241879 1.675259
H 1.606195 -5.145937 0.856439
H 2.739795 4.455052 2.333954
H 1.854555 5.071291 0.935464
H 3.420660 4.282413 0.714858
H 3.531334 1.406301 -1.107728
H 3.584450 -0.337952 -1.611773
H 4.926738 -0.066382 0.993635
H 7.140365 0.261820 -0.150562
H 6.312587 0.641712 -1.704161


%chk=000201989-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000201989

0 1
O -3.147291 1.264967 -2.013407
O 2.793871 0.106365 0.185864
N -3.756584 -0.275922 -0.382021
C -5.893202 -0.206456 0.671151
C -5.015470 -1.235998 1.428372
C -5.201219 -0.107357 -0.705027
C -3.570444 -0.933167 0.948206
C -2.808318 0.469406 -1.072908
C -1.358390 0.328747 -0.680759
C 0.651406 -1.020325 -0.195457
C 0.810218 1.459255 -0.341209
C -0.572561 1.505573 -0.629712
C -0.734720 -0.923566 -0.465661
C 1.405085 0.182717 -0.139463
C 1.296457 -2.366352 0.091901
C 1.610455 2.742044 -0.183272
C 1.459058 -2.627831 1.616218
C 1.775775 3.148755 1.308719
C 2.129561 -3.986127 1.909205
C 2.583739 4.452740 1.473642
C 3.693985 0.037820 -1.003646
C 5.104021 0.238519 -0.519010
C 6.138603 -0.583403 -0.820974
H -5.862620 0.774823 1.179413
H -6.947412 -0.521371 0.591960
H -5.303630 -2.262532 1.135715
H -5.106422 -1.159569 2.525164
H -5.342924 0.855207 -1.222598
H -5.537077 -0.914545 -1.385950
H -2.973041 -1.857553 0.872716
H -3.040712 -0.247737 1.637218
H -1.055958 2.467963 -0.831751
H -1.318119 -1.848179 -0.544369
H 2.299578 -2.426691 -0.370444
H 0.684145 -3.175792 -0.351918
H 1.104018 3.562590 -0.727376
H 2.620878 2.638368 -0.621585
H 2.061656 -1.807448 2.048486
H 0.462862 -2.585874 2.100042
H 0.772335 3.266111 1.762954
H 2.276569 2.321213 1.845592
H 2.229718 -4.156799 2.996786
H 3.142772 -4.029603 1.467142
H 1.541760 -4.824131 1.487958
H 2.686271 4.728931 2.539081
H 2.093480 5.296274 0.951313
H 3.602271 4.345136 1.053938
H 3.399562 0.837279 -1.716242
H 3.575693 -0.939818 -1.512403
H 5.262849 1.129263 0.104567
H 7.156018 -0.375190 -0.472683
H 6.000046 -1.486028 -1.429373


