%chk=000217107.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000217107

0 1
O -1.902800 -0.988248 -1.737200
O 1.295742 -2.472609 2.312245
N 1.316710 -1.014776 0.489102
N -3.450142 -0.959324 -0.069723
N -5.794266 0.734171 -0.043901
C -1.042893 -0.437792 0.444479
C 0.317150 -0.227163 -0.302433
C -0.794260 -1.557638 1.461774
C -2.146110 -0.783642 -0.555674
C 0.710739 -1.771685 1.517365
C 0.630325 1.251250 -0.393368
C -3.946448 -0.355622 1.193968
C -4.545159 -1.156480 -1.065311
C 2.706455 -1.039693 0.132948
C -4.674684 0.978433 0.916495
C -5.295621 0.163743 -1.333846
C 0.190222 1.947394 -1.530709
C 1.306725 1.936265 0.623694
C 3.652253 -1.576143 1.028743
C 3.126047 -0.530064 -1.111915
C 0.429779 3.318107 -1.646695
C 1.547509 3.308370 0.500722
C 1.109565 4.000827 -0.631755
C 5.001000 -1.595957 0.674394
C 4.481720 -0.557061 -1.443820
C 5.423939 -1.086761 -0.557651
H -1.317188 0.508032 0.974060
H 0.255319 -0.675659 -1.338973
H -1.286063 -2.511637 1.174394
H -1.181053 -1.315614 2.468823
H -3.126231 -0.206754 1.922792
H -4.661142 -1.081544 1.653682
H -5.241798 -1.921272 -0.653538
H -4.119304 -1.560027 -2.013793
H -5.120358 1.360694 1.861555
H -3.949242 1.742415 0.563858
H -4.639182 0.860475 -1.898981
H -6.182472 -0.040692 -1.974057
H -6.281104 1.618749 -0.229476
H -0.339541 1.417303 -2.324406
H 1.659696 1.400515 1.505415
H 3.336750 -1.988260 1.992113
H 2.414227 -0.113228 -1.820670
H 0.090593 3.855096 -2.531185
H 2.082201 3.835989 1.289355
H 1.300294 5.068300 -0.726317
H 5.729726 -2.014404 1.368694
H 4.804101 -0.161098 -2.406564
H 6.477174 -1.104979 -0.824808


%chk=000217107-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000217107

0 1
O -1.896356 -1.054108 -1.900623
O 1.319130 -2.701487 2.291932
N 1.358920 -1.096312 0.523976
N -3.437415 -0.599672 -0.221983
N -5.849271 0.824662 0.276713
C -0.996654 -0.664133 0.346046
C 0.372979 -0.409850 -0.366175
C -0.765379 -1.949591 1.176979
C -2.140312 -0.780439 -0.677817
C 0.744726 -1.975250 1.435976
C 0.618408 1.085348 -0.558862
C -3.857682 -0.307971 1.166445
C -4.570243 -0.697681 -1.176243
C 2.769997 -1.034890 0.269647
C -4.708997 0.981642 1.202808
C -5.415188 0.591257 -1.119125
C 0.196504 1.698099 -1.765178
C 1.184989 1.886711 0.462851
C 3.710134 -1.430290 1.260780
C 3.242288 -0.577312 -0.990537
C 0.338675 3.092182 -1.946816
C 1.332288 3.279025 0.279075
C 0.908360 3.887501 -0.925706
C 5.091854 -1.366623 0.982576
C 4.626205 -0.517493 -1.252635
C 5.562452 -0.910370 -0.269766
H -1.173687 0.184633 1.030437
H 0.338265 -0.907998 -1.355196
H -1.025243 -2.859681 0.602916
H -1.319460 -1.985444 2.128888
H -2.983701 -0.204810 1.825855
H -4.476961 -1.149362 1.536397
H -5.203647 -1.561692 -0.895497
H -4.148719 -0.863460 -2.179985
H -5.091275 1.135862 2.228215
H -4.048367 1.845857 0.941693
H -4.803936 1.431731 -1.530349
H -6.307164 0.468234 -1.759280
H -6.546209 1.573397 0.364473
H -0.251666 1.078889 -2.551812
H 1.531428 1.416155 1.390269
H 3.355239 -1.802068 2.223004
H 2.540094 -0.264199 -1.767192
H 0.010864 3.555461 -2.884348
H 1.784775 3.887880 1.070004
H 1.026939 4.967461 -1.068948
H 5.803520 -1.676928 1.756012
H 4.970307 -0.161151 -2.230006
H 6.637091 -0.861417 -0.475987


