%chk=000195473.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000195473

0 1
O 0.683834 1.618131 -0.573564
O -0.517073 3.390888 -1.201083
N -2.902360 2.610245 0.647699
C 0.536451 0.158105 -0.425678
C -0.835644 -0.158162 -1.108539
C -1.627727 1.172007 -0.988074
C 0.504680 -0.127461 1.076351
C -1.538918 -1.363708 -0.546656
C 1.718627 -0.454165 -1.187528
C 0.153452 -1.591104 1.338415
C -1.081495 -2.033355 0.603276
C -0.521282 2.224982 -0.927446
C -2.528790 1.212440 0.261221
C -2.683163 -1.835584 -1.212999
C 3.039078 -0.329529 -0.476927
C -1.777401 -3.162684 1.067125
C -3.368068 -2.956016 -0.743376
C -2.913283 -3.621536 0.400599
C 3.535641 0.938984 -0.134559
C 3.789842 -1.474416 -0.174582
C -3.638372 3.319283 -0.439217
C -3.719202 2.580070 1.899015
C 4.771555 1.057412 0.501817
C 5.028998 -1.348654 0.462164
C 5.522102 -0.085975 0.801021
H -0.653646 -0.349207 -2.198080
H -2.246207 1.345980 -1.898048
H -0.241713 0.544882 1.557571
H 1.477249 0.135755 1.539858
H 1.808542 0.047582 -2.178446
H 1.489203 -1.518219 -1.406589
H 0.034626 -1.748955 2.430664
H 1.005334 -2.242042 1.038614
H -1.964590 0.779767 1.126867
H -3.404785 0.549201 0.087590
H -3.039603 -1.321906 -2.104858
H -1.426652 -3.685732 1.955781
H -4.253159 -3.313283 -1.266372
H -3.445144 -4.497192 0.769173
H 2.940227 1.828945 -0.362584
H 3.416971 -2.461551 -0.436071
H -2.909979 3.581055 -1.230450
H -4.027190 4.277595 -0.059242
H -4.472145 2.759784 -0.882391
H -3.908333 3.618498 2.218995
H -3.137220 2.102366 2.702983
H -4.685927 2.064041 1.811793
H 5.152748 2.043055 0.765320
H 5.610538 -2.239358 0.692876
H 6.486272 0.009541 1.294972


%chk=000195473-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000195473

0 1
O 0.713945 1.712501 -0.459169
O -0.574617 3.533799 -1.077194
N -3.128746 2.657381 0.598854
C 0.553797 0.217783 -0.319343
C -0.813894 -0.080993 -1.016128
C -1.620458 1.258928 -0.904556
C 0.539751 -0.122151 1.181667
C -1.509186 -1.342998 -0.512114
C 1.722308 -0.443334 -1.098648
C 0.180351 -1.605343 1.408678
C -1.060745 -2.047758 0.639986
C -0.509931 2.321009 -0.826689
C -2.620288 1.310119 0.289183
C -2.632216 -1.832545 -1.229437
C 3.103917 -0.353049 -0.462861
C -1.763255 -3.211041 1.050606
C -3.319397 -2.991181 -0.816996
C -2.882999 -3.684748 0.337378
C 3.708620 0.904245 -0.192015
C 3.828216 -1.533394 -0.156295
C -3.843785 3.305973 -0.517633
C -3.906726 2.666698 1.852947
C 5.001103 0.972208 0.372708
C 5.123294 -1.467595 0.407736
C 5.714655 -0.212088 0.674636
H -0.597896 -0.222652 -2.095371
H -2.187349 1.449321 -1.833007
H -0.191506 0.529469 1.692188
H 1.529244 0.102945 1.615590
H 1.736402 0.028112 -2.101390
H 1.455566 -1.506680 -1.254948
H 0.036077 -1.789626 2.489868
H 1.041205 -2.237974 1.108666
H -2.132638 0.920562 1.201046
H -3.445780 0.591292 0.044173
H -2.966512 -1.295601 -2.126600
H -1.419040 -3.750022 1.942449
H -4.183828 -3.351261 -1.385454
H -3.409393 -4.584954 0.673589
H 3.155720 1.821659 -0.419091
H 3.378933 -2.512231 -0.369848
H -3.149800 3.488563 -1.354615
H -4.216199 4.290194 -0.183960
H -4.719128 2.710269 -0.885725
H -4.184363 3.705200 2.105666
H -3.289920 2.268961 2.679304
H -4.847801 2.060190 1.802820
H 5.453470 1.949911 0.574458
H 5.668511 -2.391045 0.634223
H 6.719210 -0.156227 1.109066


