%chk=000180534.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180534

0 1
O 3.913562 -0.469015 0.172575
O -2.523200 -1.960885 0.383503
N -0.955447 -0.298836 0.027922
C 5.545961 1.176738 -0.101296
C 5.895619 2.645245 -0.367182
C 4.034106 0.963985 -0.095257
C 2.660299 -1.020394 0.248197
C 0.253622 -1.042345 0.198561
C 7.406164 2.864707 -0.376291
C -3.309364 0.250704 -0.133279
C 1.463142 -0.317283 0.088792
C -4.175517 0.646120 0.903972
C -2.275876 -0.803222 0.119324
C 2.690513 -2.407448 0.510419
C 0.258532 -2.418965 0.458792
C 1.481290 -3.084760 0.611298
C -3.437720 0.798416 -1.417166
C -5.156521 1.616366 0.633637
C -4.052389 0.051456 2.265026
C -4.419557 1.755306 -1.673510
C -5.276375 2.164012 -0.643522
H 6.011399 0.518603 -0.863241
H 5.972845 0.840883 0.865839
H 5.430266 3.291436 0.403517
H 5.466818 2.967684 -1.336842
H 3.525819 1.515565 0.712801
H 3.566125 1.178933 -1.070109
H 7.861312 2.589805 0.582635
H 7.897736 2.267114 -1.153153
H 7.652906 3.915573 -0.566483
H 1.455856 0.745059 -0.111222
H -0.840659 0.699749 -0.168213
H 3.645355 -2.910573 0.626280
H -0.679702 -2.973721 0.543001
H 1.479177 -4.157643 0.813275
H -2.775168 0.467422 -2.218169
H -5.831212 1.936133 1.426199
H -3.996586 -1.052102 2.215505
H -3.137879 0.390117 2.773941
H -4.897899 0.296266 2.920198
H -4.523485 2.178678 -2.670460
H -6.044069 2.912216 -0.842914


%chk=000180534-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000180534

0 1
O 4.027386 -0.598521 0.178155
O -2.576546 -1.900774 0.730634
N -0.876952 -0.351060 0.238501
C 5.592382 1.197203 -0.237650
C 5.810030 2.694472 -0.558044
C 4.108523 0.842504 -0.122042
C 2.755474 -1.173241 0.326159
C 0.302534 -1.138114 0.377726
C 7.305416 3.058322 -0.679350
C -3.197931 0.365249 0.051250
C 1.542619 -0.458137 0.209467
C -4.373561 0.550313 0.843778
C -2.215983 -0.736817 0.375128
C 2.743307 -2.562965 0.608152
C 0.278093 -2.526265 0.662909
C 1.508140 -3.215932 0.771725
C -2.976256 1.179723 -1.092337
C -5.274053 1.578057 0.464678
C -4.674655 -0.301702 2.063213
C -3.892337 2.188541 -1.457253
C -5.045981 2.391192 -0.668202
H 6.049630 0.571860 -1.028169
H 6.098915 0.936689 0.711329
H 5.342506 3.315062 0.233707
H 5.290719 2.949950 -1.504507
H 3.624162 1.420713 0.693761
H 3.575086 1.055386 -1.073243
H 7.843055 2.846548 0.263701
H 7.791728 2.472349 -1.481498
H 7.441272 4.129971 -0.912887
H 1.543142 0.615442 -0.010198
H -0.726153 0.641578 0.042755
H 3.695919 -3.093507 0.692466
H -0.677250 -3.033743 0.797341
H 1.495529 -4.289226 0.991058
H -2.103168 0.992426 -1.729529
H -6.172515 1.738185 1.072370
H -4.877175 -1.346050 1.769746
H -3.816390 -0.343679 2.758020
H -5.547544 0.095438 2.608928
H -3.713954 2.798243 -2.349442
H -5.767368 3.171419 -0.935405


